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Jinan Trio PharmaTech Co., Ltd.

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Profile: Jinan Trio PharmaTech Co., Ltd. specializes in APIs & intermediates, heterocyclic compounds, and anti-tumor drugs. Our products include crizotinib, vemurafenib, afatinib, vandetanib, regorafenib, brivanib alaninate, pyridazine, imidazole, pyrazole, and oxazole. We are specialized in providing over 1000 products including molecular targeted anticancer drugs, cell signaling pathway inhibitors, pharmaceutical intermediates, and heterocyclic compounds, and quality services including custom synthesis, transfer of new drug patent and technology, technical cooperation, and process optimization.

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• 4-(FLUOROPHENYL)-5-(1-METHYLETHOXY)-6-NITRO ETHYL BENZOFURANCARBOXYLATE
IUPAC Name: ethyl 2-(4-fluorophenyl)-6-nitro-5-propan-2-yloxy-1-benzofuran-3-carboxylate | CAS Registry Number: 691857-07-5
Synonyms: SureCN3535937, BEN258, 3-Benzofurancarboxylic acid, 2-(4-fluorophenyl)-5-(1-methylethoxy)-6-nitro-, ethyl ester, ETHYL 2-(4-FLUOROPHENYL)-5-ISOPROPOXY-6-NITROBENZOFURAN-3-CARBOXYLATE

Molecular Formula: C20H18FNO6Molecular Weight: 387.358423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: BHQFYUQLUYVORD-UHFFFAOYSA-N

• 4-CHLORO-5-HYDRAZINYLPYRIDAZIN-3(2H)-ONE
IUPAC Name: 5-chloro-4-hydrazinyl-1H-pyridazin-6-one | CAS Registry Number: 6959-56-4
Synonyms: Oprea1_356751, NSC66068, 4-Chloro-5-hydrazino-3-pyridazinol, MolPort-000-652-091, AIDS125227, AIDS-125227, CID248667, NSC 66068, STK399957, ZINC08622317, 4-chloro-5-hydrazinylpyridazin-3(2H)-one, F3095-3409

Molecular Formula: C4H5ClN4OMolecular Weight: 160.561700 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: OIGROUYSAFLMAO-UHFFFAOYSA-N

• 4-METHOXYCINNOLINE
IUPAC Name: 4-methoxycinnoline | CAS Registry Number: 3397-78-2
Synonyms: 4-Methoxycinnoline, 4-Cinnolinyl methyl ether, NSC158309, AIDS127334, AIDS-127334, CID292501, NSC 158309

Molecular Formula: C9H8N2OMolecular Weight: 160.172620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XVPKWOIIQKBTFD-UHFFFAOYSA-N

• 4-VINYL-BENZALDEHYDE
IUPAC Name: 4-ethenylbenzaldehyde | CAS Registry Number: 1791-26-0
Synonyms: 4-vinylbenzaldehyde, 4-ethenylbenzaldehyde, 4-Formylstyrene, 4-Vinyl-benzaldehyde, Benzaldehyde,4-ethenyl-, AC1Q6Q5Q, AC1L21N1, CTK4D7201, UNII-76025X541R, ZINC02006168, AKOS006228133, AG-E-29519, Benzaldehyde,p-vinyl- (6CI,7CI,8CI); 4-Formylstyrene; 4-Vinylbenzaldehyde;4-Vinylsalicylaldehyde; p-Formylstyrene; p-Vinylbenzaldehyde

Molecular Formula: C9H8OMolecular Weight: 132.159220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QBFNGLBSVFKILI-UHFFFAOYSA-N

• 4H-PYRAN-4-ONE,2-HYDROXY-6-METHYL-
IUPAC Name: 4-hydroxy-6-methylpyran-2-one | CAS Registry Number: 70254-61-4
Synonyms: 4-Hydroxy-6-methyl-2-pyrone, 675-10-5, Triacetic acid lactone, 4-Hydroxy-6-methyl-2H-pyran-2-one, Triacetate lactone, 2-Hydroxy-6-methyl-4H-pyran-4-one, 4-hydroxy-6-methylpyran-2-one, 2H-PYRAN-2-ONE, 4-HYDROXY-6-METHYL-, CHEMBL54907, 6-methyl-4-hydroxy-2-pyrone, CCRIS 3600, 6-Methyl-4-hydroxypyron-(2), 4-Hydroxy-6-methylpyran-4-one, CHEBI:16458, EINECS 211-619-2, NSC 34625, 3,5-Dihydroxysorbic acid delta-lactone, BRN 0113815, PubChem9569, Spectrum_001904

Molecular Formula: C6H6O3Molecular Weight: 126.110040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NSYSSMYQPLSPOD-UHFFFAOYSA-N

• 5-CHLORO-6-HYDROXYNICOTINONITRILE
IUPAC Name: 5-chloro-6-oxo-1H-pyridine-3-carbonitrile | CAS Registry Number: 19840-46-1
Synonyms: 5-chloro-6-hydroxynicotinonitrile, 5-chloro-6-hydroxypyridine-3-carbonitrile, CTK4E2514, MolPort-009-194-566, ANW-56689, SBB087037, ZINC22995856, AKOS005072505, AG-E-44991, GC-0740, MCULE-7430578258, RP10109, AK-68350, KB-73458, 5-chloro-6-oxo-1H-pyridine-3-carbonitrile, FT-0681072, Nicotinonitrile,5-chloro-6-hydroxy- (8CI), X3336, A813986, 3-Pyridinecarbonitrile,5-chloro-1,6-dihydro-6-oxo-

Molecular Formula: C6H3ClN2OMolecular Weight: 154.553820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QIZPRLXDVKDBRQ-UHFFFAOYSA-N

• 6-[2-(TERT-BUTYL)-5-(6-METHYL-PYRIDIN-2-YL)-1H-IMIDAZOL-4-YL]QUINOXALINE
IUPAC Name: 6-[2-tert-butyl-5-(6-methylpyridin-2-yl)-1H-imidazol-4-yl]quinoxaline | CAS Registry Number: 356559-20-1
Synonyms: SB-525334, SB 525334, AG-F-23697, 6-[2-TERT-BUTYL-5-(6-METHYL-PYRIDIN-2-YL)-1H-IMIDAZOL-4-YL]-QUINOXALINE, SB525334, SB 525334, 356559-20-1, 6-(2-(tert-Butyl)-5-(6-methylpyridin-2-yl)-1H-imidazol-4-yl)quinoxaline, SB525334, SB 525334, S1476_Selleck, SureCN373474, SureCN10000768, cc-539, CHEMBL401570, QCR-68, CTK4H5088, CHEBI:535646, HMS3262O09, ABP000161, ANW-71297, DNC010927, AKOS016008294

Molecular Formula: C21H21N5Molecular Weight: 343.424940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DKPQHFZUICCZHF-UHFFFAOYSA-N

• 2-BROMO-4-CHLORO-1-NITRO-BENZENE
IUPAC Name: 2-bromo-4-chloro-1-nitrobenzene | CAS Registry Number: 63860-31-1
Synonyms: 2-bromo-4-chloro-1-nitrobenzene, 2-bromo-4-chloro-1-nitro-benzene, 2-Bromo-4-chloronitrobenzene, AG-G-37940, SureCN1511847, CTK5C0001, MolPort-003-987-891, ANW-50185, ZINC21303469, AKOS015835262, Benzene, 2-bromo-4-chloro-1-nitro-, AM61617, RP28240, AK-35960, BR-35960, KB-21270, TL8007215, FT-0647521, W7568

Molecular Formula: C6H3BrClNO2Molecular Weight: 236.450520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VFMAPIFSXMBTQP-UHFFFAOYSA-N

• 7-bromo-2-chloroquinazoline
IUPAC Name: 7-bromo-2-chloroquinazoline | CAS Registry Number: 953039-66-2
Synonyms: 7-BROMO-2-CHLOROQUINAZOLINE, AG-H-92496, PubChem14676, CTK5H7631, MolPort-009-198-398, ANW-64188, AKOS015835909, PB10831, QC-1077, RP28612, QUINAZOLINE, 7-BROMO-2-CHLORO-, AK-24796, BR-24796, KB-46141, FT-0648796, W9736, A11141

Molecular Formula: C8H4BrClN2Molecular Weight: 243.487760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LEVIQMAFISIVMA-UHFFFAOYSA-N

• 3-PYRIDAZINECARBALDEHYDE,97%
IUPAC Name: pyridazine-3-carbaldehyde | CAS Registry Number: 60170-83-4
Synonyms: 3-Pyridazinecarbaldehyde, 3-pyridazinecarboxaldehyde, PYRIDAZINE-3-CARBALDEHYDE, AG-G-15172, PubChem23311, 3-FORMYLPYRIDAZINE, AGN-PC-00KG8A, CTK5B1086, MolPort-008-421-110, PYRIDAZINE-3 CARBOXALDEHYDE, AKOS006294185, PB20119, RP08409, AB1010409, KB-184160, AM20100469, BB 0258112, A832626, 3-Pyridazinecarboxaldehyde;Pyridazine-3-carbaldehyde, I14-14556

Molecular Formula: C5H4N2OMolecular Weight: 108.098060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YRUFRSUZZACWCW-UHFFFAOYSA-N

• 1-(3-methylisoxazol-5-yl)ethanone
IUPAC Name: 1-(3-methyl-1,2-oxazol-5-yl)ethanone | CAS Registry Number: 55086-61-8
Synonyms: ZINC26506537, EN001268

Molecular Formula: C6H7NO2Molecular Weight: 125.125280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MOBMLOWIGFJSCP-UHFFFAOYSA-N

• 6-bromo-4-chlorocinnoline
IUPAC Name: 6-bromo-4-chlorocinnoline | CAS Registry Number: 68211-15-4
Synonyms: MolPort-006-727-770, EN000430

Molecular Formula: C8H4BrClN2Molecular Weight: 243.487760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WAKDQKOZUBTOEX-UHFFFAOYSA-N

• 5-[2-[4-[2-(Dimethylamino)ethoxy]phenyl]-5-(4-Pyridinyl)-1H-Imidazol-4-Yl]-2,3-Dihydro-1H-Inden-1-One Oxime
IUPAC Name: N,N-dimethyl-2-[4-[4-(1-nitroso-2,3-dihydroinden-5-ylidene)-5-(1H-pyridin-4-ylidene)-1H-imidazol-2-yl]phenoxy]ethanamine | CAS Registry Number: 405554-55-4
Synonyms: SB-590885, CTK1D4868, HMS3244C05, HMS3244C06, HMS3244D05, HMS3265I03, HMS3265I04, HMS3265J03, HMS3265J04, NCGC00242249-02, KB-80510, 5-[2-[4-[2-(Dimethylamino)ethoxy]phenyl]-5-(4-pyridinyl)-1H-imidazol-4-yl]-2,3-dihydro-1H-inden-1-one oxime

Molecular Formula: C27H27N5O2Molecular Weight: 453.535580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: DPCXEUSDRQOOGZ-UHFFFAOYSA-N

• 3-Methyl-4-phenyl-3-buten-2-one
IUPAC Name: (E)-3-methyl-4-phenylbut-3-en-2-one | CAS Registry Number: 1901-26-4
Synonyms: Methylbenzylideneacetone, 3-Benzylidene-2-butenone, Benzylidene methyl ethyl ketone, FEMA No. 2734, .alpha.-Methylbenzylideneacetone, 1-Methyl-1-benzylidene-acetone, alpha-Methyl-alpha-benzalacetone, Methyl alpha-methylstyryl ketone, 3-Buten-2-one, 3-methyl-4-phenyl-, 4-Phenyl-3-methyl-3-buten-2-one, EINECS 217-599-1, NSC 46888, BRN 0774487, 3-METHYL-4-PHENYL-3-BUTEN-2-ONE, CID5370646, LS-47315, 2-07-00-00298 (Beilstein Handbook Reference)

Molecular Formula: C11H12OMolecular Weight: 160.212380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BQJFBHBDOAIIGS-CMDGGOBGSA-N

• 4-Iodo-1H-benzimidazole
IUPAC Name: 4-iodo-1H-benzimidazole | CAS Registry Number: 51288-04-1
Synonyms: 4-Iodo-1H-benzo[d]imidazole, 4-IODO-1H-BENZIMIDAZOLE, 1H-Benzimidazole,7-iodo-, SureCN3171067, SureCN3232202, CTK4J3974, MolPort-000-004-490, ANW-60921, ZINC26898752, AKOS016003400, AG-F-73400, QC-1129, AK-78404, KB-65136

Molecular Formula: C7H5IN2Molecular Weight: 244.032470 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: MOYBHUHLLQSMNP-UHFFFAOYSA-N

• (E)-3-(Dimethylamino)-1-(Pyridin-3-Yl)Prop-2-En-1-One
IUPAC Name: (E)-3-(dimethylamino)-1-pyridin-3-ylprop-2-en-1-one | CAS Registry Number: 123367-26-0
Synonyms: 3-(dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one, 55314-16-4, 1-(3-Pyridyl)-3-(dimethylamino)-2-propen-1-one, (E)-3-(Dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one, (E)-3-Dimethylamino-1-pyridin-3-yl-propenone, (2E)-3-(dimethylamino)-1-(pyridin-3-yl)prop-2-en-1-one, 3-[3-(Dimethylamino)acryloyl]pyridine, AC1NSSFR, 2-Dimethylamino-1-(3-pyridyl)-2-propene-1-one, SureCN1643, AC1Q5CUB, dimethylaminopyridinylpropenone, 3-(Dimethylamino)-1-(3-pyridyl)prop-2-en-1-one, MolPort-001-757-800, BB_SC-5631, ACT10865, AR-1E7560, BBL010460, SBB065455, STK719874

Molecular Formula: C10H12N2OMolecular Weight: 176.215080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MZLRFUCMBQWLNV-FNORWQNLSA-N

• 3-Amino-4-Iodoindazole
IUPAC Name: 4-iodo-1H-indazol-3-amine | CAS Registry Number: 599191-73-8
Synonyms: 4-iodo-1H-indazol-3-amine, MolPort-001-756-749, ZINC06025558, CID4057787, GC-0607, EN000582

Molecular Formula: C7H6IN3Molecular Weight: 259.047110 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: OEQIVIYSUJXCFG-UHFFFAOYSA-N

• 6-Bromophthalazin-1(2H)-one
IUPAC Name: 6-bromo-2H-phthalazin-1-one | CAS Registry Number: 75884-70-7
Synonyms: 6-BROMOPHTHALAZIN-1(2H)-ONE, AG-H-02651, 6-bromo-2H-phthalazin-1-one, 6-bromophthalazin-1-ol, SureCN396016, SureCN396021, KSC642C5D, 1(2H)-Phthalazinone,6-bromo-, 6-bromanyl-2H-phthalazin-1-one, CTK5E2151, MolPort-009-199-535, ANW-44914, AKOS015834799, AK-72822, BR-72822, KB-45006, C-8797, A838538, W-60385, I01-7401

Molecular Formula: C8H5BrN2OMolecular Weight: 225.042100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QMONLZVJOOMKRW-UHFFFAOYSA-N

• 4-[[9-Chloro-7-(2,6-difluorophenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]benzoic acid
IUPAC Name: 4-[[9-chloro-7-(2,6-difluorophenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]benzoic acid | CAS Registry Number: 869363-13-3
Synonyms: MLN8054, MLN-8054, MLN 8054, S1100_Selleck, Kinome_1204, CHEMBL259084, MLN 8054, MLN-8054, 869363-13-3, ZZL, 4-((9-chloro-7-(2,6-difluorophenyl)-5h-pyrimido(5,4-d)(2)benzazepin-2-yl)amino)benzoic acid, 4-{[9-chloro-7-(2,6-difluorophenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino}benzoic acid, CID11712649, CID 11712649, SureCN621589, AGN-PC-00EMZ4, UNII-BX854EHD63, cc-475, CTK3E6235, HMS3265K23, HMS3265K24, HMS3265L23

Molecular Formula: C25H15ClF2N4O2Molecular Weight: 476.862006 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: HHFBDROWDBDFBR-UHFFFAOYSA-N

• 3-Aminopyrazine-2-Carbonitrile
IUPAC Name: 3-aminopyrazine-2-carbonitrile | CAS Registry Number: 25911-65-3
Synonyms: 3-aminopyrazine-2-carbonitrile, AC1LG9PX, AC1Q1I7N, SureCN2877700, 3-amino-2-pyrazinecarbonitrile, 2-AMINO-3-CYANOPYRAZINE, 3-amino-pyrazine-2-carbonitrile, CTK1A1495, MolPort-003-823-956, ACT03769, ANW-72877, AR-1F1965, QC-288, RW2364, SBB068642, WTI-11632, ZINC00331853, AKOS011966863, AB10707, AG-E-80330

Molecular Formula: C5H4N4Molecular Weight: 120.112060 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: GPIZLEHIVRHDAW-UHFFFAOYSA-N

• 4-[[(4S,5R)-4,5-Bis(4-Chlorophenyl)-4,5-Dihydro-2-[4-Methoxy-2-(1-Methylethoxy)phenyl]-1H-Imidazol-1-Yl]carbonyl]-2-Piperazinone
IUPAC Name: 4-[(4S,5R)-4,5-bis(4-chlorophenyl)-2-(4-methoxy-2-propan-2-yloxyphenyl)-4,5-dihydroimidazole-1-carbonyl]piperazin-2-one | CAS Registry Number: 675576-98-4
Synonyms: nutlin-3A, Nutlin 3a, nutlin 3, Nutlin-3a chiral, SureCN1155752, UNII-L7C92IOE65, cc-452, CHEMBL191334, S8059,(-)-Nutlin-3, CHEBI:417700, MolPort-009-019-256, DNC006637, BCP9001003, CS-0296, RL04569, HY-10029, Nutlin-3a chiral|675576-98-4|Nutlin 3a, 2-Piperazinone, 4-(((4S,5R)-4,5-bis(4-chlorophenyl)-4,5-dihydro-2-(4-methoxy-2-(1-methylethoxy)phenyl)-1H-imidazol-1-yl)carbonyl)-

Molecular Formula: C30H30Cl2N4O4Molecular Weight: 581.489600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: BDUHCSBCVGXTJM-WUFINQPMSA-N

• 4-Oxazolidinecarboxylic Acid
IUPAC Name: (4S)-1,3-oxazolidin-3-ium-4-carboxylate | CAS Registry Number: 306274-78-2
Synonyms: ZINC04202447

Molecular Formula: C4H7NO3Molecular Weight: 117.103280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XFZIPCXDWCWTCH-VKHMYHEASA-N

• 2-Chlorlindole
IUPAC Name: 3-chloro-1H-indole | CAS Registry Number: 16863-96-0
Synonyms: 3-chloro-1H-indole, 1H-indole, 3-chloro-, MolPort-001-782-444, CID177790, InChI=1/C8H6ClN/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5,10

Molecular Formula: C8H6ClNMolecular Weight: 151.592940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: GVSMQKKMAYLKMM-UHFFFAOYSA-N

• 2-Pyridinecarboxylic Acid, 6-Chloro-4-Methoxy-, Methyl Ester
IUPAC Name: methyl 6-chloro-4-methoxypyridine-2-carboxylate | CAS Registry Number: 204378-41-6
Synonyms: methyl 6-chloro-4-methoxypicolinate, methyl6-chloro-4-methoxypicolinate, 6-Chloro-4-methoxy-2-pyridinecarboxylic acid methyl ester, CTK8C2307, ANW-68181, SBB069013, ZINC49587147, AKOS015851536, AK-80645, AM803480, KB-199341, A4447, FT-0657937, S02-0202, 6-Chloro-4-methoxy-pyridine-2-carboxylic acid methyl ester

Molecular Formula: C8H8ClNO3Molecular Weight: 201.607020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: PCBQMUWCNOOYDT-UHFFFAOYSA-N

• 5-Bromo-2-Chloro-3-Pyridinecarbonyl Chloride
IUPAC Name: 5-bromo-2-chloropyridine-3-carbonyl chloride | CAS Registry Number: 78686-86-9
Synonyms: AG-H-15683, 2-CHLORO-5-BROMONICOTINOYL CHLORIDE, PYR071, CTK2H6908, 5-Bromo-2-chloro-nicotinoyl chloride, 5-Bromo-2-chloronicotinoyl chloride;, KB-106797, KB-169843, 3-Pyridinecarbonylchloride, 5-bromo-2-chloro-, 3-Pyridinecarbonyl chloride, 5-bromo-2-chloro-, 5-BROMO-2-CHLORO-3-PYRIDINECARBONYL CHLORIDE

Molecular Formula: C6H2BrCl2NOMolecular Weight: 254.896180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZXLONDRTSKAJOQ-UHFFFAOYSA-N

• 4-Amino-2,6-Dimethylpyridine
IUPAC Name: 2,6-dimethylpyridin-4-amine | CAS Registry Number: 3512-80-9
Synonyms: 4-Amino-2,6-lutidine, 2,6-Dimethylpyridin-4-amine, 4-Pyridinamine, 2,6-dimethyl-, NSC5090, 2,6-dimethylpyridin-4-ylamine, CID77047, EINECS 222-515-1, D3945G1, AC-907/34119009

Molecular Formula: C7H10N2Molecular Weight: 122.167700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ZJXMKPARTVOUAM-UHFFFAOYSA-N

• 2-Pyridylthiourea
IUPAC Name: pyridin-2-ylthiourea | CAS Registry Number: 14294-11-2
Synonyms: NSC176341, ZINC05594482, CID1490491, GL-0767, T5989645

Molecular Formula: C6H7N3SMolecular Weight: 153.204880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: SLUHLANJIVXTRQ-UHFFFAOYSA-N

• 2-(Trifluoromethyl)-1,3-Thiazole-4-Carbaldehyde
IUPAC Name: 2-(trifluoromethyl)-1,3-thiazole-4-carbaldehyde | CAS Registry Number: 133046-48-7
Synonyms: 2-(Trifluoromethyl)thiazole-4-carbaldehyde, 2-Trifluoromethyl-4-thiazolecarboxaldehyde, 4-Formyl-2-(trifluoromethyl)-1,3-thiazole, 2-(trifluoromethyl)-1,3-thiazole-4-carbaldehyde, 2-(Trifluoromethyl)-1,3-thiazole-4-carboxaldehyde, PubChem24252, ACMC-20adc3, CTK0G9329, MolPort-008-155-886, ANW-68209, AKOS006303414, AB60783, QC-3523, RP03227, 2-Trifluoromethyl-4-thiazolecarbaldehyde, AK-80611, KB-69715, Y7426, I14-32001

Molecular Formula: C5H2F3NOSMolecular Weight: 181.135690 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: KOEUGSAJYCOTJL-UHFFFAOYSA-N

• 3(2H)-Pyridazinone, 5-Iodo-
IUPAC Name: 4-iodo-1H-pyridazin-6-one | CAS Registry Number: 825633-94-1
Synonyms: 5-Iodopyridazin-3(2H)-one, 5-Iodo-2,3-dihydropyridazin-3-one, SureCN700125, CTK3E6188, MolPort-000-882-218, ACT10941, ANW-46839, 5-Iodo-2,3-dihydropyridazin-3-one;, AKOS000278383, AG-I-03306, RP27352, AK-39251, BR-39251, KB-43479, WT-130459, FT-0687750, W8629, I14-12903

Molecular Formula: C4H3IN2OMolecular Weight: 221.983890 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UZWMMCWOUBWROK-UHFFFAOYSA-N

• 5-Pyrimidinecarboxylic Acid, 4-Amino-2-Chloro-
IUPAC Name: 4-amino-2-chloropyrimidine-5-carboxylic acid | CAS Registry Number: 773109-69-6
Synonyms: 4-AMINO-2-CHLOROPYRIMIDINE-5-CARBOXYLIC ACID, AG-H-09094, 4-amino-2-chloropyrimidine-5-carboxylicacid, CTK2H6837, MolPort-020-237-565, ANW-69399, RW3471, AKOS006295259, QC-2107, AK-28689, KB-36272, A9785, 5-Pyrimidinecarboxylicacid, 4-amino-2-chloro-, I03-0402, 4-Amino-2-chloropyrimidine-5-carboxylic acid;5-pyrimidinecarboxylic acid, 4-amino-2-chloro-;

Molecular Formula: C5H4ClN3O2Molecular Weight: 173.557160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: WANKDJMLEJFSMC-UHFFFAOYSA-N

• (aS)-N-[(1S)-2-[[(7S)-6,7-Dihydro-5-methyl-6-oxo-5H-dibenz[b,d]azepin-7-yl]amino]-1-methyl-2-oxoethyl]-3,5-difluoro-alpha-hydroxybenzeneacetamide
IUPAC Name: (2S)-2-[[(2S)-2-(3,5-difluorophenyl)-2-hydroxyacetyl]amino]-N-[(7S)-5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl]propanamide | CAS Registry Number: 209984-57-6
Synonyms: LY-411575, LY411575, LY 411575, 209984-57-6 pound not LY 411575 pound not LY-411575, SureCN33171, cc-581, CHEMBL392068, CHEBI:499634, BCP9000887, CS-0309, RL02594, NCGC00346841-01, HY-50752, LS-193033, LY-411575|209984-57-6|LY 411575, (2S)-2-[(2S)-2-(3,5-difluorophenyl)-2-hydroxyacetamido]-N-[(10S)-8-methyl-9-oxo-8-azatricyclo[9.4.0.0^{2,7}]pentadeca-1(11),2(7),3,5,12,14-hexaen-10-yl]propanamide, ly 411575;(as)-n-((1s)-2-(((7s)-6,7-dihydro-5-methyl-6-oxo-5h-dibenz(b,d)azepin-7-yl)amino)-1-methyl-2-oxoethyl)-3,5-difluoro-alpha-hydroxybenzeneacetamide, M/A

Molecular Formula: C26H23F2N3O4Molecular Weight: 479.475326 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: ULSSJYNJIZWPSB-CVRXJBIPSA-N

• 2',3'-di-o-acetyl-5'-deoxy-5-fluoro-d-cytidine
IUPAC Name: [(2R,3R,4R,5R)-4-acetyloxy-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2-methyloxolan-3-yl] acetate | CAS Registry Number: 161599-46-8
Synonyms: 2',3'-DI-O-ACETYL-5'-DEOXY-5-FLUOROCYTIDINE, 5'-Deoxy-2',3'-di-O-acetyl-5-fluorocytidine, AG-E-11324, 2',3'-Di-O-acetyl-5'-deoxy-5-fuluro-D-cytidine, Cytidine, 5'-deoxy-5-fluoro-, 2',3'-diacetate, PubChem10352, 2',3'-Di-O-acetyl-5'-deoxy-5-fluoro-D-cytidine, UNII-Q6KTK8KQR2, SureCN935809, KSC530S0B, CYT009, CTK4D0900, MolPort-019-903-956, ACN-S001563, ACT05300, AMX10129, ANW-45300, AKOS015966242, AK-44559, KB-67320

Molecular Formula: C13H16FN3O6Molecular Weight: 329.281043 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: NWJBWNIUGNXJGO-RPULLILYSA-N

• 4-(Boc-amino)pyridine
IUPAC Name: tert-butyl N-pyridin-4-ylcarbamate | CAS Registry Number: 98400-69-2
Synonyms: 4-(tert-butoxycarbonylamino)pyridine, tert-butyl pyridin-4-ylcarbamate, tert-Butyl N-(4-Pyridyl)carbamate, tert-butyl N-(pyridin-4-yl)carbamate, ST50825371, PubChem20060, ACMC-209sa9, SureCN334709, KSC495M3F, 658707_ALDRICH, N-BOC-4-AMINO-PYRIDINE, CTK3J5632, MolPort-003-938-454, ANW-40927, ZINC12478475, AKOS009462060, AB11054, AG-B-09192, MCULE-4179072837, RP03968

Molecular Formula: C10H14N2O2Molecular Weight: 194.230360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DRZYCRFOGWMEES-UHFFFAOYSA-N

• 7-Chloro-5-methyl-1H-pyrrolo[2,3-c]pyridine
IUPAC Name: 7-chloro-5-methyl-1H-pyrrolo[2,3-c]pyridine | CAS Registry Number: 930790-43-5
Synonyms: CTK8C2257, MolPort-008-155-905, ANW-68096, AKOS006308855, QC-1037, AK-80751, KB-66260, 1H-Pyrrolo[2,3-c]pyridine,7-chloro-5-methyl-

Molecular Formula: C8H7ClN2Molecular Weight: 166.607580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LJOHJVFZZKPMKE-UHFFFAOYSA-N

• 4-Chloro-5-methoxypyridazin-3(2H)-one
IUPAC Name: 5-chloro-4-methoxy-1H-pyridazin-6-one | CAS Registry Number: 63910-43-0
Synonyms: 4-CHLORO-5-METHOXYPYRIDAZIN-3(2H)-ONE, AG-G-38458, 4-chloro-5-methoxy-3(2H)-pyridazinone, 5-chloro-4-methoxy-1H-pyridazin-6-one, 4-chloro-5-methoxy-2H-pyridazin-3-one, AC1LGE4M, AC1Q3FXE, SureCN5844344, KSC498C5J, CTK3J8154, MolPort-002-051-409, ANW-48734, AR-1G1701, SBB055930, ZINC00335693, AKOS006241453, RL04436, AK-72598, BR-72598, KB-37992

Molecular Formula: C5H5ClN2O2Molecular Weight: 160.558400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SUZFURZANOKZBL-UHFFFAOYSA-N

• 4-Methyl-5-oxazolecarboxylic acid
IUPAC Name: 4-methyl-1,3-oxazole-5-carboxylic acid | CAS Registry Number: 2510-32-9
Synonyms: NSC158017, CID292311, CC 10001

Molecular Formula: C5H5NO3Molecular Weight: 127.098100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZIXUNDOOBLSXPE-UHFFFAOYSA-N

• 2-Amino-4-chloro-3-nitropyridine
IUPAC Name: 4-chloro-3-nitropyridin-2-amine | CAS Registry Number: 6980-08-1
Synonyms: 4-chloro-3-nitropyridin-2-amine, 2-Amino-3-nitro-4-chloropyridine, 4-Chloro-3-nitro-2-pyridinamine, 4-Chloro-3-nitro-pyridin-2-ylamine, AG-G-72325, PubChem17739, SureCN783847, AC1N3WO3, KSC352M6B, CTK2F2660, MolPort-003-824-032, ANW-51893, GEO-02458, RW3675, WTI-10145, ZINC22048227, AKOS005256521, PB30811, QC-2726, RL04674

Molecular Formula: C5H4ClN3O2Molecular Weight: 173.557160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DIRINUVNYFAWQF-UHFFFAOYSA-N

• 3-Amino-4-nitropyridine
IUPAC Name: 4-nitropyridin-3-amine | CAS Registry Number: 13505-02-7
Synonyms: 4-nitropyridin-3-amine, 4-Nitro-3-pyridinamine, 4-NITRO-PYRIDIN-3-YLAMINE, 3-Pyridinamine, 4-nitro-, PubChem6690, AC1LBPU8, SureCN1284068, 4-NITRO-3-PYRIDYLAMINE, CTK0H4252, MolPort-003-824-064, ANW-61794, SBB065327, WTI-10432, ZINC14982118, AKOS006339143, AKOS015891668, AB18008, AG-D-71767, QC-3869, RP20511

Molecular Formula: C5H5N3O2Molecular Weight: 139.112100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: SXIUYRNIWXQXEA-UHFFFAOYSA-N

• 5-Cyanoindole-3-carboxyaldehyde
IUPAC Name: 3-formyl-1H-indole-5-carbonitrile | CAS Registry Number: 17380-18-6
Synonyms: 5-Cyano-3-formyl indole, 3-Formylindole-5-carbonitrile, BRN 0389069, INDOLE-5-CARBONITRILE, 3-FORMYL-, LS-82440, C-8870, 5-22-06-00313 (Beilstein Handbook Reference)

Molecular Formula: C10H6N2OMolecular Weight: 170.167440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NVBCFOQYDFKXJJ-UHFFFAOYSA-N

• 1-Piperidinepropanenitrile, 4-methyl-3-(methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-b-oxo-, (3R,4R)-
IUPAC Name: 3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile | CAS Registry Number: 477600-75-2
Synonyms: Tasocitinib, Tofacitinib, CP-690550, CP 690550, 3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile, UNII-87LA6FU830, CHEBI:71200, Tofacitinib (USAN), Tofacitinib [USAN], CP690550, 3-{(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl}-3-oxopropanenitrile, CP-690550, Tasocitinib, CP690550, tofacitinibum, 3eyg, 3fup, 3-((3R,4R)-4-Methyl-3-(methyl(7H-pyrrolo(2,3-d)pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile, Tasocitinib [INN], PubChem16767, Tofacitinib [USAN:INN], SureCN322753

Molecular Formula: C16H20N6OMolecular Weight: 312.369600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: UJLAWZDWDVHWOW-YPMHNXCESA-N

• 4-Pyridazinecarboxylic acid, ethyl ester
IUPAC Name: ethyl pyridazine-4-carboxylate | CAS Registry Number: 39123-39-2
Synonyms: Ethyl Pyridazine-4-carboxylate, ethyl 4-pyridazinecarboxylate, AG-F-38097, SureCN501752, ethylpyridazine-4-carboxylate, CTK1C1279, MolPort-005-932-650, ANW-71650, ZINC22008426, AKOS016007399, 4-pyridazinecarboxylic acid ethyl ester, RL03490, 4-Pyridazinecarboxylicacid, ethyl ester;, AK-77135, KB-51652, A824415

Molecular Formula: C7H8N2O2Molecular Weight: 152.150620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: FVBGGKYTKXFLOV-UHFFFAOYSA-N

• 1H-Benzimidazole-6-carboxamide, 5-[(4-bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-
IUPAC Name: 6-(4-bromo-2-chloroanilino)-7-fluoro-N-(2-hydroxyethoxy)-3-methylbenzimidazole-5-carboxamide | CAS Registry Number: 606143-52-6
Synonyms: Selumetinib, AZD 6244, AZD6244, AZD-6244, ARRY-142886, 5-[(4-BROMO-2-CHLOROPHENYL)AMINO]-4-FLUORO-N-(2-HYDROXYETHOXY)-1-METHYL-1H-BENZIMIDAZOLE-6-CARBOXAMIDE, CHEMBL1614701, NCGC00189073-01, NCGC00189073-02, DSSTox_CID_28870, DSSTox_RID_83139, DSSTox_GSID_48944, 5-(4-broMo-2-chlorophenylaMino)-4-fluoro-N-(2-hydroxyethoxy)-1-Methyl-1H-benzo[d]iMidazole-6-carboxaMide, CAS-606143-52-6, 1H-Benzimidazole-6-carboxamide, 5-((4-bromo-2-chlorophenyl)amino)-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-, PubChem21092, AZD 6244 Selumetinib, Selumetinib (USAN/INN), Array142886, AZD6244 - Selumetinib

Molecular Formula: C17H15BrClFN4O3Molecular Weight: 457.681403 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: CYOHGALHFOKKQC-UHFFFAOYSA-N

• 4-(Pyridazin-3-Yl)Benzaldehyde
IUPAC Name: 4-pyridazin-3-ylbenzaldehyde | CAS Registry Number: 328125-39-9
Synonyms: 4-(PYRIDAZIN-3-YL)BENZALDEHYDE, CTK4G9372, AKOS006290775, AG-F-10002, KB-239191

Molecular Formula: C11H8N2OMolecular Weight: 184.194020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BGBGYYXYKMRMCT-UHFFFAOYSA-N

• 2,3-Lutidine-N-oxide
IUPAC Name: 2,3-dimethyl-1-oxidopyridin-1-ium | CAS Registry Number: 22710-07-2
Synonyms: 2,3-dimethylpyridine 1-oxide, 2,3-Dimethylpyridine-n-oxide, 2,3-Dimethylpyridine N-oxide, 2,3-dimethyl-4-pyridine-N-Oxide, 2,3-dimethyl-1-oxidopyridin-1-ium, STK368462, ZINC02565642, SureCN538571, 2,3-dimethylpyridin-1-ol, AC1MZ0Q4, CTK4D2370, MolPort-002-321-225, 2,3-dimethylpyridin-1-ium-1-olate, ANW-60788, AKOS005444206, AG-E-15979, RP17990, 2,3-dimethyl-1-oxidanidyl-pyridin-1-ium, AC-15815, AK-80131

Molecular Formula: C7H9NOMolecular Weight: 123.152460 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QWLULCKKOHDCIE-UHFFFAOYSA-N

• 5-Amino-2-bromo-6-iodopyridine
IUPAC Name: 6-bromo-2-iodopyridin-3-amine | CAS Registry Number: 915006-52-9
Synonyms: 6-Bromo-2-iodopyridin-3-amine, CTK8B8677, 3-Pyridinamine,6-bromo-2-iodo-, ANW-61015, AKOS016003413, QC-2883, 5-AMINO-2-BROMO-6-IODOPYRIDINE, AK-68363, KB-71078

Molecular Formula: C5H4BrIN2Molecular Weight: 298.907130 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UZVBAENLXVNXCL-UHFFFAOYSA-N

• 5-Nitropyridine-2,3-diamine
IUPAC Name: 5-nitropyridine-2,3-diamine | CAS Registry Number: 3537-14-2
Synonyms: NSC107296, CID3480151

Molecular Formula: C5H6N4O2Molecular Weight: 154.126740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: JOQJNCSAEMIZOU-UHFFFAOYSA-N

• 6-Hydroxynicotinamide
IUPAC Name: 6-oxo-1H-pyridine-3-carboxamide | CAS Registry Number: 3670-59-5
Synonyms: MolPort-002-471-593, MolPort-004-767-384, AIDS020412, AIDS-020412, CID72925, Nicotinamide, 1,6-dihydro-6-oxo-, ZINC12505139, 1,6-Dihydro-6-oxo-3-pyridinecarboxamide, 3-Pyridinecarboxamide, 1,6-dihydro-6-oxo-, EN300-25893, H80073, T5662384

Molecular Formula: C6H6N2O2Molecular Weight: 138.124040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NGPNYDVHEUXWIA-UHFFFAOYSA-N

• 4-Nitro-1-oxo-6H-pyridin-6-amine
IUPAC Name: 1-hydroxy-4-nitropyridin-2-imine | CAS Registry Number: 52092-45-2
Synonyms: 1-hydroxy-4-nitro-pyridin-2-imine, NSC112720, CID3918400

Molecular Formula: C5H5N3O3Molecular Weight: 155.111500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: JBLZCSZQDBHOAQ-UHFFFAOYSA-N

• (S)-1-(2,6-Dichloro-3-fluorophenyl)ethanol
IUPAC Name: (1S)-1-(2,6-dichloro-3-fluorophenyl)ethanol | CAS Registry Number: 877397-65-4
Synonyms: (S)-1-(2,6-dichloro-3-fluorophenyl)ethanol, (1S)-1-(2,6-Dichloro-3-fluorophenyl)ethanol, AG-H-54132, PubChem17375, AC1Q29ME, SureCN1581742, KSC497A2N, CTK3J7026, MolPort-005-313-574, ANW-52455, WTI-10557, ZINC12506507, AKOS015840146, LS30132, QC-1071, RP12156, AK-36674, BR-36674, KB-03511, AM20060441

Molecular Formula: C8H7Cl2FOMolecular Weight: 209.044983 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JAOYKRSASYNDGH-BYPYZUCNSA-N

• 5-(1H-INDOL-3-YLMETHYL)-3-METHYL-2-THIOXO-4-IMIDAZOLIDINONE
IUPAC Name: 5-(1H-indol-3-ylmethyl)-3-methyl-2-sulfanylideneimidazolidin-4-one | CAS Registry Number: 4311-88-0
Synonyms: Necrostatin-1, MTH-DL-Tryptophan, MTH-trp, Nec-1, nchembio.83-comp1, nchembio711-1, methyl-thiohydantoin-tryptophan, Oprea1_645908, CBDivE_006695, Bio-0868, N9037_SIGMA, Necroptotic Inhibitor, Nec-1, methylthiohydantoin-DL-tryptophan, CHEBI:430803, MolPort-002-131-513, IN1207, CID2828334, NCGC00092372-01, NCGC00092372-02, 5-(Indol-3-ylmethyl)-(2-thio-3-methyl)hydantoin

Molecular Formula: C13H13N3OSMolecular Weight: 259.326820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: TXUWMXQFNYDOEZ-UHFFFAOYSA-N


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