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Ningbo Pangs Chem Int'l Co., Ltd.

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Profile: Ningbo Pangs Chem Int'l Co., Ltd. is a supplier of natural plant extracts, nutritional supplements and chemical materials. Our product line includes pharmaceutical chemicals such as 4-hydroxycoumarin, 5-fluorouracil, adenine, baclofen, biapenem, captopril, dimetridazole, glimepiride, nateglinide, niflumic acid, morniflumate, chitosan and metoprolol. We offer nutritional additives such as fructose, chondroitin sulfate, melatonin, calcium caseinate, calcium citrate, calcium gluconate, ferrous lactate and potassium sorbate.

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• 3-Hydroxy-1-methylpiperidine
IUPAC Name: 1-methylpiperidin-3-ol | CAS Registry Number: 3554-74-3
Synonyms: 1-Methyl-3-piperidinol, N-Methyl-3-piperidinol, 3-Piperidinol, 1-methyl-, N-Methyl-3-hydroxypiperidine, 1-Methylpiperidin-3-ol, 3-Hydroxy-N-methylpiperidine, 1-Methyl-3-hydroxypiperidine, H42001_ALDRICH, 55750_FLUKA, BB_SC-2158, NSC68348, EINECS 222-609-2, NSC 68348, TL8002638, 97275-25-7

Molecular Formula: C6H13NOMolecular Weight: 115.173520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UKANCZCEGQDKGF-UHFFFAOYSA-N

• 1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine
IUPAC Name: 1-(3-chlorophenyl)-4-(3-chloropropyl)piperazine | CAS Registry Number: 39577-43-0
Synonyms: NSC520934, EINECS 254-529-9, CID101444, ST5307311

Molecular Formula: C13H18Cl2N2Molecular Weight: 273.201420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NDQKGEFMUGSRNS-UHFFFAOYSA-N

• 2-Aminomethyl-phenylacetic acid
IUPAC Name: 2-[2-(aminomethyl)phenyl]acetic acid | CAS Registry Number: 40851-65-8
Synonyms: 2-Aminomethylphenylacetic acid, (2-(Aminomethyl)phenyl)acetic acid, EINECS 255-110-3, TL8002967

Molecular Formula: C9H11NO2Molecular Weight: 165.189140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: VLOIVYPDUSVCLZ-UHFFFAOYSA-N

• 2,4-Dichlorothiazole
IUPAC Name: 2,4-dichloro-1,3-thiazole | CAS Registry Number: 4175-76-2
Synonyms: 2,4-dichloro-1,3-thiazole, 2,4-Dichloro-thiazole, dichlorothiazole, ACMC-1ALBT, SureCN149587, AC1Q3KS4, KSC235O9B, CTK1D5790, MolPort-002-471-879, ANW-29670, SBB086954, ZINC08939671, AKOS005072743, AG-F-48504, FD-0206, MCULE-3625040467, RP10083, AK-23570, BR-23570, KB-17484

Molecular Formula: C3HCl2NSMolecular Weight: 154.017740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ICETWLGKJXCIDX-UHFFFAOYSA-N

• 3-Chlorobenzisothiazole
IUPAC Name: 3-chloro-1,2-benzothiazole | CAS Registry Number: 7716-66-7
Synonyms: 3-Chloro-1,2-benzisothiazole, 1,2-Benzisothiazole, 3-chloro-, ZINC02380704, CID598190, ST5408344, TL8005303, AA-516/25012032

Molecular Formula: C7H4ClNSMolecular Weight: 169.631360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BCPVKLRBQLRWDQ-UHFFFAOYSA-N

• 1H-Imidazole-1-acetic acid monohydrochloride
IUPAC Name: 2-imidazol-1-ylacetic acid;hydrochloride | CAS Registry Number: 87266-37-3
Synonyms: 1H-Imidazole-1-acetic acid hydrochloride, 2-(1H-imidazol-1-yl)acetic acid hydrochloride, SBB065721, 1H-imidazol-1-ylacetic acid hydrochloride, 1H-Imidazole-1-aceticacid,monohydrochloride, Acetic acid, 2-(1H-imidazol-1-yl) hydrochloride, (1H-Imidazol-1-yl)-acetic acid, zlchem 363, PubChem7609, PubChem8383, AC1Q3F0H, AGN-PC-00KLV9, SureCN1904485, CTK3F0738, 1H-Imidazole-1-acetic acid HCl, ZLC0207, MolPort-003-848-154, ANW-59999, AKOS015892557, Imidazol-1-ylacetic acid hydrochloride

Molecular Formula: C5H7ClN2O2Molecular Weight: 162.574280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JKZJSYXGKHQHRA-UHFFFAOYSA-N

• 2,5-dibromothiophene
IUPAC Name: 2,5-dibromothiophene | CAS Registry Number: 3141-27-3
Synonyms: 2,5-DIBROMOTHIOPHENE, Thiophene, 2,5-dibromo-, NSC4488, 108472_ALDRICH, CID18453, NSC 4488, EINECS 221-547-3, ZINC01673411, AI3-08106, ST5406255, TL8002401, InChI=1/C4H2Br2S/c5-3-1-2-4(6)7-3/h1-2

Molecular Formula: C4H2Br2SMolecular Weight: 241.931680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KBVDUUXRXJTAJC-UHFFFAOYSA-N

• 1-benzyl-3-piperidone Hydrochloride Hydrate
IUPAC Name: 1-(phenylmethyl)piperidin-1-ium-3-one | CAS Registry Number: 50606-58-1
Synonyms: ZINC00119573, CID3527570

Molecular Formula: C12H16NO+Molecular Weight: 190.261540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BBQQULRBTOMLTC-UHFFFAOYSA-O

• (2R,3S/2S,3R)-3-(4-Chloro-5-fluoro-6-pyrimidinyl)-2-(2,4-difluorophenyl)butan-2-ol hydrochloride
IUPAC Name: 3-(6-chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)butan-2-ol;hydrochloride | CAS Registry Number: 188416-35-5
Synonyms: 3-(6-Chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)butan-2-ol hydrochloride, (2r,3s/2s,3r)-3-(4-chloro-5-fluoro-6-pyrimidinyl)-2-(2,4-difluorophenyl)butan-2-ol hydrochloride, CTK8B4562, ANW-45482, AKOS015998846, AM84649, LS41049, AK-59614, A24986, I01-3344, (2r,3s/2s,3r)-3-(4-Chloro-5-Fluoro-6-Pyrimidinyl)-2-(2,4-Difluorophenyl)-1-(1h-1,2,4-Triazol- 1-Yl)-2- Butanol Hydrochloride;(2R,3S/2S,3R)-3-(6-Chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol- 1-yl)-2- butanol hydrochloride

Molecular Formula: C14H13Cl2F3N2OMolecular Weight: 353.167030 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: KNFRQNVARBDXRG-UHFFFAOYSA-N

• 1-(2,4-Dimethylphenyl)piperazine
IUPAC Name: 1-(2,4-dimethylphenyl)piperazine | CAS Registry Number: 1013-76-9
Synonyms: 1-(2,4-Xylyl)piperazine, EINECS 213-797-7, 1-(2,4-Dimethylphenyl)Piperazine, CID70544, PDSP1_000004, PDSP2_000004, SBB003650, TL8000088

Molecular Formula: C12H18N2Molecular Weight: 190.284720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RUIMBVCRNZHCRQ-UHFFFAOYSA-N

• 1-(4-Cyanophenyl)piperazine
IUPAC Name: 4-piperazin-1-ylbenzonitrile | CAS Registry Number: 68104-63-2
Synonyms: 4-Piperazinobenzonitrile, 4-(piperazin-1-yl)benzonitrile, 4-piperazin-1-ylbenzonitrile, 4-piperazinobenzenecarbonitrile, 4-piperazin-1-yl-benzonitrile, SBB005810, 4-piperazinylbenzenecarbonitrile, 116290-72-3, PubChem13344, ACMC-1BFD3, SureCN231077, AC1MC04Q, SureCN6956744, 95516_ALDRICH, 1-(4-Cyanophenyl)-piperazine, AC1Q4R31, 4-n-(4-cyano phenyl)piperazine, 95516_FLUKA, CTK5C7316, Benzonitrile,4-(1-piperazinyl)-

Molecular Formula: C11H13N3Molecular Weight: 187.241020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DJJNYEXRPRQXPD-UHFFFAOYSA-N

• 2-hydrazin-4-methylbenzothiazole
IUPAC Name: (4-methyl-1,3-benzothiazol-2-yl)hydrazine | CAS Registry Number: 20174-68-9
Synonyms: IFLab1_006387, 2-Hydrazino-4-methylbenzothiazole, ZINC02455643, CID88394, EINECS 243-562-4, SL-02191, 4-Methylbenzothiazol-2(3H)-one hydrazone, 2(3H)-Benzothiazolone, 4-methyl-, hydrazone

Molecular Formula: C8H9N3SMolecular Weight: 179.242160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DYWNRVWOUASMDT-UHFFFAOYSA-N

• 2-Benzyl Acrylic Acid
IUPAC Name: 2-benzylprop-2-enoic acid | CAS Registry Number: 62479-28-1
Synonyms: 2-Benzylacrylic Acid, 5669-19-2, 2-benzyl acrylic acid, 2-benzylprop-2-enoic acid, NSC192640, 2-(benzyl)acrylic acid, SureCN41907, ACMC-1B2R5, KSC497S9H, CTK3J7993, MolPort-003-980-303, 2-(phenylmethyl)-2-propenoic acid, 2-(phenylmethyl)prop-2-enoic acid, 2-Methylene-3-phenylpropionic Acid, AC1L7310, ACT00329, ANW-32569, SBB063023, AKOS006283947, AG-F-99412

Molecular Formula: C10H10O2Molecular Weight: 162.185200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RYNDYESLUKWOEE-UHFFFAOYSA-N

• 3,4,5-Tribromopyrazole
IUPAC Name: 3,4,5-tribromo-1H-pyrazole | CAS Registry Number: 17635-44-8
Synonyms: Pyrazole, 3,4,5-tribromo-, ZINC02168426, 1H-Pyrazole, 3,4,5-tribromo-, BTB06439, CID627674, I14-1563

Molecular Formula: C3HBr3N2Molecular Weight: 304.765440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: TXQKCKQJBGFUBF-UHFFFAOYSA-N

• 1-Chloro-2-Methyl-2-Propanol
IUPAC Name: 1-chloro-2-methylpropan-2-ol | CAS Registry Number: 558-42-9
Synonyms: Chloro-tert-butyl alcohol, 1-Chloro-2-methyl-2-propanol, 1-Chloro-tert-butyl alcohol, 1-Chloro-2-methylpropan-2-ol, 167592_ALDRICH, NSC46574, CID68409, EINECS 209-196-4, OR4348, ZINC01678735

Molecular Formula: C4H9ClOMolecular Weight: 108.566660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JNOZGFXJZQXOSU-UHFFFAOYSA-N

• -(Methylamino)-1-Phenyl-1-Propanone Hydrochloride
IUPAC Name: 3-(methylamino)-1-phenylpropan-1-one chloride | CAS Registry Number: 2538-50-3
Synonyms: NSC9981

Molecular Formula: C10H13ClNO-Molecular Weight: 198.669320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: VIHLSOFMDHEDRK-UHFFFAOYSA-M

• 2-Amino-4-hydroxypyrimidine
IUPAC Name: 2-amino-1H-pyrimidin-6-one | CAS Registry Number: 108-53-2
Synonyms: Isocytosine, 2-Aminouracil, Isocytosine (VAN), 2-Amino-4-pyrimdinol, 2-Amino-4-pyrimidone, 2-Amino-4-oxypyrimidine, 2-Amino-4-pyrimidol, 4-Pyrimidinol, 2-amino-, 4(3H)-Pyrimidinone, 2-amino-, 2-aminopyrimidin-4(1H)-one, 2-aminopyrimidin-4(3H)-one, 4(1H)-Pyrimidinone, 2-amino-, I2127_SIGMA, 2-Amino-3H-pyrimidin-4-one, AIDS020793, AIDS045569, AIDS081807, AIDS-020793, AIDS-045569, AIDS-081807

Molecular Formula: C4H5N3OMolecular Weight: 111.102000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XQCZBXHVTFVIFE-UHFFFAOYSA-N

• 2-Chloro-3,5-dinitrobenzoic acid
IUPAC Name: 2-chloro-3,5-dinitrobenzoic acid | CAS Registry Number: 2497-91-8
Synonyms: WLN: WNR BG CVQ ENW, NSC4538, 2-Carboxy-4,6-dinitrochlorobenzene, NSC 4538, EINECS 219-684-9, BENZOIC ACID, 2-CHLORO-3,5-DINITRO-, CID17247, BRN 2146480, SBB003177, LS-36473, PB262299054, 4-09-00-01359 (Beilstein Handbook Reference), InChI=1/C7H3ClN2O6/c8-6-4(7(11)12)1-3(9(13)14)2-5(6)10(15)16/h1-2H,(H,11,12

Molecular Formula: C7H3ClN2O6Molecular Weight: 246.561520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: ADTKEYLCJYYHHH-UHFFFAOYSA-N

• 2'-Chloro-2'-deoxycytidine
IUPAC Name: 4-amino-1-[(2R,3R,4R,5R)-3-chloro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one | CAS Registry Number: 10212-19-8
Synonyms: 2'-chloro-2'-deoxycytidine, 2'-Deoxy-2'-chlorocytidine, SureCN10890901, CTK4A0697, AKOS015911420, AG-D-10488, KB-169320, Cytidine,2'-chloro-2'-deoxy- (8CI,9CI), FT-0636656, V1398, I14-8739, I14-39289, 2-Chloro-2'-deoxycytidine;2'-Deoxy-2'-chlorocytidine;

Molecular Formula: C9H12ClN3O4Molecular Weight: 261.662280 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: LOZPBORRQPATRO-XVFCMESISA-N

• 2-Chloro-5-nitropyrimidine
IUPAC Name: 2-chloro-5-nitropyrimidine | CAS Registry Number: 10320-42-0
Synonyms: Ambap4214, 2-Chloro-5-nitropyrimidin, Pyrimidine, 2-chloro-5-nitro-, NSC528724, CID82544, EINECS 233-703-8, TL8000144

Molecular Formula: C4H2ClN3O2Molecular Weight: 159.530580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OFCBNMYNAHUDGE-UHFFFAOYSA-N

• 2-Amino-5-methyl-1,3,4-thiadiazole
IUPAC Name: 5-methyl-1,3,4-thiadiazol-2-amine | CAS Registry Number: 108-33-8
Synonyms: MATD, USAF CY-3, 2-Amino-5-methylthiadiazole, MLS001049227, 1,3,4-Thiadiazol-2-amine, 5-methyl-, 5-Methyl-1,3,4-thiadiazol-2-amine, 1,3,4-Thiadiazole, 2-amino-5-methyl-, EINECS 203-573-7, TOS-BB-1084, WLN: T5NN DSJ C1 E1, ZERO/004544, 1,4-Thiadiazol-2-amine, 5-methyl-, 2-Methyl-5-amino-1,3,4-thiadiazole, 5-Methyl-1,3,4-thiadiazole-2-amine, NSC 137228, CID66949, 5-Methyl-1,3,4-thiadiazol-2-ylamine, Amino-5-methyl-1,3,4-thiadiazole, NSC137228, NSC526661

Molecular Formula: C3H5N3SMolecular Weight: 115.156900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HMPUHXCGUHDVBI-UHFFFAOYSA-N

• 1-Amino-4-hydroxyanthraquinone
IUPAC Name: 1-amino-4-hydroxyanthracene-9,10-dione | CAS Registry Number: 116-85-8
Synonyms: Calcosyn Pink B, Celutate Pink B, Nacelan Pink B, Amacel Pink B, Celutate Pink BN, Celutate Pink BY, Cibacete Red 3B, Disperse Red 2S, Setacyl Pink 3B, Cibacet Red 3B, Duranol Red 2B, Para M, Artisil Red 3BP, Cibacet Red E3B, Neosetile Pink BN, Perliton Pink 3B, Disperse Red 15, Microsetile Pink BN, Disperse red 25, Oracet red 3B

Molecular Formula: C14H9NO3Molecular Weight: 239.226160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: AQXYVFBSOOBBQV-UHFFFAOYSA-N

• 2,2'-(5-Methyl-1,3-phenylene)di(2-methylpropanenitrile)
IUPAC Name: 2-[3-(2-cyanopropan-2-yl)-5-methylphenyl]-2-methylpropanenitrile | CAS Registry Number: 120511-72-0
Synonyms: 3,5-Bis(2-cyanoprop-2-yl)toluene, Pentamethyl-1,3-benzenediacetonitrile, 2,2'-(5-Methyl-1,3-phenylene)bis(2-methylpropanenitrile), 1,3-Benzenediacetonitrile,a1,a1,a3,a3,5-pentamethyl-, 2,2-(5-Methyl-1-,3-phenylene)di(2-methylpropiononitrile), PubChem14361, ACMC-1C6FE, AGN-PC-00R8FQ, SureCN1172829, CTK4B1911, MolPort-003-985-824, ANW-46631, SBB063217, ZINC21985858, AKOS005257888, AC-6803, AG-D-44789, 3,5-Bis(2-cyano-2-methylethyl)toluene, AK-55794, EN001317

Molecular Formula: C15H18N2Molecular Weight: 226.316820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SJECEXNMZXMXNE-UHFFFAOYSA-N

• 3,5-Difluoromandelic acid
IUPAC Name: 2-(3,5-difluorophenyl)-2-hydroxyacetic acid | CAS Registry Number: 132741-31-2
Synonyms: 541842_ALDRICH, CID588648, ST5407305, D1169

Molecular Formula: C8H6F2O3Molecular Weight: 188.128246 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: PHMLPPFFMSRWBK-UHFFFAOYSA-N

• 2-Bromopropiophenone
IUPAC Name: 2-bromo-1-phenylpropan-1-one | CAS Registry Number: 2114-00-3
Synonyms: 1-Benzoyl-1-bromoethane, alpha-Bromopropiophenone, 1-Bromoethyl phenyl ketone, 1-Propanone, 2-bromo-1-phenyl-, .alpha.-Bromopropiophenone, PROPIOPHENONE, 2-BROMO-, WLN: EY1&VR, B79684_ALDRICH, TL 336, 471607_ALDRICH, EINECS 218-307-5, NSC 89689, NSC89689, BRN 0508550, LS-125063, 4-07-00-00684 (Beilstein Handbook Reference), 78541-87-4

Molecular Formula: C9H9BrOMolecular Weight: 213.071160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WPDWOCRJBPXJFM-UHFFFAOYSA-N

• 3-Cyano-2-hydroxy-4-methoxypyridine
IUPAC Name: 4-methoxy-2-oxo-1H-pyridine-3-carbonitrile | CAS Registry Number: 21642-98-8
Synonyms: ZINC00168323, CID2786702, TL8006950, 2K-028, 1,2-Dihydro-4-methoxy-2-oxo-3-pyridinecarbonitrile, 4-Methoxy-2-oxo-1,2-dihydro-pyridine-3-carbonitrile, 3-Pyridinecarbonitrile, 1,2-dihydro-4-methoxy-2-oxo-

Molecular Formula: C7H6N2O2Molecular Weight: 150.134740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MWGIDWPSRDMIQN-UHFFFAOYSA-N

• 1-Phenylpiperazine hydrochloride
IUPAC Name: 1-phenylpiperazine | CAS Registry Number: 2210-93-7
Synonyms: N-Phenylpiperazine, Phenylpiperazine, Piperazine, 1-phenyl-, 1-PHENYLPIPERAZINE, 1-Cyclohexylpiperazine, 1-Fenylpiperazin [Czech], N-Phenyldiethylenediamine, CCRIS 4334, P30004_ALDRICH, 75475_FLUKA, EINECS 202-165-6, CID7096, C10H14N2, BRN 0132157, SBB003943, AI3-26332, TL806457, LS-113091, 5-23-01-00160 (Beilstein Handbook Reference), AE-641/30105013

Molecular Formula: C10H14N2Molecular Weight: 162.231560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YZTJYBJCZXZGCT-UHFFFAOYSA-N

• 1-Benzylpiperidine-4-carboxylic acid ethyl ester
IUPAC Name: ethyl 1-(phenylmethyl)piperidine-4-carboxylate | CAS Registry Number: 24228-40-8
Synonyms: Oprea1_210266, Ethyl 1-benzylpiperidine-4-carboxylate, CID90423, SDCCGMLS-0066147.P001, EINECS 246-094-9, ST5320008

Molecular Formula: C15H21NO2Molecular Weight: 247.332740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ASQCOPJFYLJCGD-UHFFFAOYSA-N

• 1-(1,3-Benzodioxol-5-yl-methyl)piperazine
IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)piperazine | CAS Registry Number: 32231-06-4
Synonyms: 1-Piperonylpiperazine, Piperonyl piperazine, MLS001194789, 1-(3,4-Methylenedioxybenzyl)piperazine, 224952_ALDRICH, EINECS 250-968-5, BRN 0885038, Piperazine, 1-(3,4-methylenedioxybenzyl)-, BAS 00531883, SMR000554828, 1-(1,3-Benzodioxol-5-ylmethyl)piperazine, 1-Benzo[1,3]dioxol-5-ylmethyl-piperazine, LS-112853, ST5300067, TL8002450, 5-23-02-00526 (Beilstein Handbook Reference), 38063-96-6

Molecular Formula: C12H16N2O2Molecular Weight: 220.267640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: NBOOZXVYXHATOW-UHFFFAOYSA-N

• 3-Bromo-2-chlorothiophene
IUPAC Name: 3-bromo-2-chlorothiophene | CAS Registry Number: 40032-73-3
Synonyms: 512389_ALDRICH, ZINC01023254, ST5405450, InChI=1/C4H2BrClS/c5-3-1-2-7-4(3)6/h1-2

Molecular Formula: C4H2BrClSMolecular Weight: 197.480680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KSHOQKKCPJELBV-UHFFFAOYSA-N

• 3-Thiophenecarbonyl chloride
IUPAC Name: thiophene-3-carbonyl chloride | CAS Registry Number: 41507-35-1
Synonyms: 3-Thenoyl chloride, EINECS 255-420-9, ZINC02504558, CC 13102

Molecular Formula: C5H3ClOSMolecular Weight: 146.594720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QTWBEVAYYDZLQL-UHFFFAOYSA-N

• 3,5-Dithia-1,7-heptanediol
IUPAC Name: 2-(2-hydroxyethylsulfanylmethylsulfanyl)ethanol | CAS Registry Number: 44860-68-6
Synonyms: Bis(2-hydroxyethylthio)methane, 3,5-Dithiaheptane-1,7-diol, NSC 2875, EINECS 256-166-1, NSC2875, 2,2'-(Methylenebis(thio))bisethanol, Ethanol, 2,2'-[methylenebis(thio)]bis-, NSC409772, 2,2'-[Methylenebis(thio)]bisethanol, Ethanol, 2,2'-(methylenebis(thio))bis-, AI3-18188, LS-66886

Molecular Formula: C5H12O2S2Molecular Weight: 168.277580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: GAECBAMNQFGJIM-UHFFFAOYSA-N

• 3-(Hydroxymethyl)piperidine
IUPAC Name: piperidin-3-ylmethanol | CAS Registry Number: 4606-65-9
Synonyms: 3-Piperidinemethanol, 3-Piperidinylmethanol, Piperidin-3-ylmethanol, 155233_ALDRICH, EINECS 225-013-0, TL8003195

Molecular Formula: C6H13NOMolecular Weight: 115.173520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VUNPWIPIOOMCPT-UHFFFAOYSA-N

• 1-Methylindazole-3-carboxylic acid
IUPAC Name: 1-methylindazole-3-carboxylic acid | CAS Registry Number: 50890-83-0
Synonyms: 637645_ALDRICH, ALBB-006391, 1-methyl-1H-indazole-3-carboxylic acid, 1-Methyl-indazole-3-carboxylic acid, CID689105, SBB000193, TL8003376, AQ-358/41297702

Molecular Formula: C9H8N2O2Molecular Weight: 176.172020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OVVDFORZEGKEJM-UHFFFAOYSA-N

• 4-Ethyl-4'-cyanobiphenyl
IUPAC Name: 4-(4-ethylphenyl)benzonitrile | CAS Registry Number: 58743-75-2
Synonyms: Ambap1007, 4-Cyano-4'-ethylbiphenyl, ZINC01260186, CID93890, EINECS 261-414-7, 4'-Ethyl(1,1'-biphenyl)-4-carbonitrile, 4'-Ethyl[1,1'-biphenyl]-4-carbonitrile, TL8003759, (1,1'-Biphenyl)-4-carbonitrile, 4'-ethyl-, [1,1'-Biphenyl]-4-carbonitrile, 4'-ethyl-

Molecular Formula: C15H13NMolecular Weight: 207.270420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DLLIPJSMDJCZRF-UHFFFAOYSA-N

• 2-Amino-3-nitrophenol
IUPAC Name: 2-amino-3-nitrophenol | CAS Registry Number: 603-85-0
Synonyms: 3-Nitro-2-aminophenol, Phenol, 2-amino-3-nitro-, 2-Hydroxy-6-nitroaniline, CCRIS 2544, 1-Hydroxy-2-amino-3-nitrobenzene, 297003_ALDRICH, EINECS 210-060-1, ZINC04272219, LS-188167, TL8002257

Molecular Formula: C6H6N2O3Molecular Weight: 154.123440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: KUCWUAFNGCMZDB-UHFFFAOYSA-N

• 2,3-Dimethoxy-5-methyl-1,4-benzoquinone
IUPAC Name: 2,3-dimethoxy-5-methylcyclohexa-2,5-diene-1,4-dione | CAS Registry Number: 605-94-7
Synonyms: Ubiquinone-0, Coenzyme Q0, Ubiquinone 0, Ubiquinone-O, Ubiquinone Q0, CoQ0, nchembio.62-comp10, Ccris 7153, D9150_SIGMA, 2-Methyl-4,5-dimethoxy-p-quinone, 2,3-Dimethoxy-5-methylbenzoquinone, STOCK1N-17426, 2,3-Dimethoxy-5-methyl-p-benzoquinone, CHEBI:27906, 2,3-Dimethoxy-5-methylbenzo-1,4-quinone, 2-Methyl-5,6-dimethoxybenzoquinone, CID69068, EINECS 210-100-8, CPD0-1464, p-Benzoquinone, 2,3-dimethoxy-5-methyl-

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: UIXPTCZPFCVOQF-UHFFFAOYSA-N

• 1-(2-Tetrahydrofuroyl)piperazine
IUPAC Name: oxolan-2-yl(piperazin-1-yl)methanone | CAS Registry Number: 63074-07-7
Synonyms: 1-(2-Tetrahydrofuroyl)-piperazine, 1-(Tetrahydro-2-furoyl)piperazine, SBB005794, TL8004377

Molecular Formula: C9H16N2O2Molecular Weight: 184.235540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UKESBLFBQANJHH-UHFFFAOYSA-N

• 1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone
IUPAC Name: 1-(4-chlorophenyl)-4,4-dimethylpentan-3-one | CAS Registry Number: 66346-01-8
Synonyms: HWG 1608-Alkylketon, ZINC02562558, CID94617, 3-Pentanone, 1-(4-chlorophenyl)-4,4-dimethyl-, LS-101927, TL8004699, 1-(4-chlorophenyl)-4,4-dimethylpentan-3-one, T5379927

Molecular Formula: C13H17ClOMolecular Weight: 224.726480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ILQGIJDYSLHIOX-UHFFFAOYSA-N

• 6-Chloro-1,3-dimethyl-2,4(1H,3H)-pyrimidinedione
IUPAC Name: 6-chloro-1,3-dimethylpyrimidine-2,4-dione | CAS Registry Number: 6972-27-6
Synonyms: 6-Chloro-1,3-dimethyluracil, C5663_SIGMA, NSC61919, EINECS 230-205-2, ZINC00333864, ST5307850, 6-Chloro-2,4-dihydroxy-1,3-dimethylpyrimidine, AH-262/02642049, 6-chloro-1,3-dimethyl-2,4(1H,3H)-pyrimidinedione

Molecular Formula: C6H7ClN2O2Molecular Weight: 174.584980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VATQPUHLFQHDBD-UHFFFAOYSA-N

• 3-(1-Piperidinylmethyl)phenol
IUPAC Name: 3-(piperidin-1-ylmethyl)phenol | CAS Registry Number: 73279-04-6
Synonyms: 3-(1-Piperidinomethyl)phenol, 3-(piperidin-1-ylmethyl)phenol, 1-(3-Hydroxybenzyl)piperidine, AE-641/11702937, AG-G-89555, PubChem6815, ACMC-209oqd, AC1LGU1M, SureCN3154468, Oprea1_133944, 3-(1-piperidyl methyl)phenol, CTK5D7717, MolPort-002-801-163, Phenol,3-(1-piperidinylmethyl)-, ANW-36323, AKOS006343444, MCULE-8999393592, AC-19427, AK141974, KB-26385

Molecular Formula: C12H17NOMolecular Weight: 191.269480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ORGBERFQYFWYGX-UHFFFAOYSA-N

• (E)Ethyl4-(3,4-dimethoxyphenyl)-4-oxo-2-butenoate
IUPAC Name: (E)-4-(3,4-dimethoxyphenyl)-4-oxobut-2-enoic acid | CAS Registry Number: 80937-23-1
Synonyms: EINECS 279-631-0, BRN 3137849, 4-(3,4-Dimethoxyphenyl)-4-oxocrotonic acid, LS-47127, (E)-4-(3,4-Dimethoxyphenyl)-4-oxo-2-butenoic acid, 3-10-00-04602 (Beilstein Handbook Reference), 2-Butenoic acid, 4-(3,4-dimethoxyphenyl)-4-oxo-, (E)-, Acide (E)4-(3,4-dimethoxy-phenyl)-4-oxo-2-butenoique [French]

Molecular Formula: C12H12O5Molecular Weight: 236.220680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: QUWWWXPLUJFEHM-GQCTYLIASA-N

• 3-(4'-Fluorobenzy)-2-chlorobenzimidazole
IUPAC Name: 2-chloro-1-[(4-fluorophenyl)methyl]benzimidazole | CAS Registry Number: 84946-20-3
Synonyms: 568694_ALDRICH, EINECS 284-624-0, CID3020241, 1-(4-Fluorobenzyl)-2-chlorobenzimidazole, 2-Chloro-1-(4-Fluorobenzyl)benzimidazole, 2-Chloro-1-(4-fluorobenzyl)-1H-benzimidazole, 2-Chloro-1-((4-fluorophenyl)methyl)-1H-benzimidazole

Molecular Formula: C14H10ClFN2Molecular Weight: 260.694003 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PGXALMVNIRPELS-UHFFFAOYSA-N

• 3-(Trifluoromethyl)pyrazole
IUPAC Name: 5-(trifluoromethyl)-1H-pyrazole | CAS Registry Number: 20154-03-4
Synonyms: 3-(trifluoromethyl)-1H-pyrazole, 5-(trifluoromethyl)-1H-pyrazole, 3-Trifluoromethylpyrazole, trifluoromethylpyrazole, 3-trifluoromethyl-1h-pyrazole, 1H-Pyrazole, 3-(trifluoromethyl)-, SBB000068, 1087160-38-0, ZINC04243565, PubChem10164, PubChem10423, ACMC-1CMGJ, AC1LXT7P, AC1Q4JHM, AC1Q4JHN, SureCN158876, SureCN255580, 3-(trifluoro methyl)pyrazole, KSC201S9J, 5-Trifluoromethyl-1H-pyrazole

Molecular Formula: C4H3F3N2Molecular Weight: 136.075230 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: PYXNITNKYBLBMW-UHFFFAOYSA-N

• 2',3'-Dideoxyuridine
IUPAC Name: 1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione | CAS Registry Number: 5983-09-5
Synonyms: ddUrd, Ambap340, Uridine, 2',3'-dideoxy-, 323624_ALDRICH, AIDS000911, AIDS-000911, ZINC00120594, DDU, D2U

Molecular Formula: C9H12N2O4Molecular Weight: 212.202580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BTOTXLJHDSNXMW-POYBYMJQSA-N

• 1-Benzyl-4-Phenylpiperazine
IUPAC Name: (1R)-1-pyridin-3-ylethanol | CAS Registry Number: 3074-46-2
Synonyms: 3-Pyridylmethylcarbinol, ZINC02383113, CID10796735, EN400-14316

Molecular Formula: C7H9NOMolecular Weight: 123.152460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QMDUEBURHKSKDG-ZCFIWIBFSA-N

• 1-Methyl-4-Ethoxycarbonylpyraole-5-Sulfonamide (CAS: 88396-81-6)
• 1,3-Indandione
IUPAC Name: indene-1,3-dione | CAS Registry Number: 606-23-5
Synonyms: 1,3-INDANDIONE, 1,3-Indandion, 1,3-Diketohydrindene, Indan-1,3-dione, 1,3-Indanone, 1H-Indene-1,3(2H)-dione, 1,3-Dioxoindan, INDANEDIONE-1,3, I2002_ALDRICH, 45790_RIEDEL, NSC 6312, EINECS 210-109-7, NSC6312, NSC 26329, AIDS017987, AIDS-017987, NSC26329, BRN 1210061, STK202114, LS-81118

Molecular Formula: C9H6O2Molecular Weight: 146.142740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UHKAJLSKXBADFT-UHFFFAOYSA-N

• 3-Amino-4-Cyanopyrazole
IUPAC Name: 5-amino-1H-pyrazole-4-carbonitrile | CAS Registry Number: 16617-46-2
Synonyms: 3-Amino-4-cyanopyrazole, 5-Amino-4-cyanopyrazole, 3-Amino-4-pyrazolecarbonitrile, 3-Aminopyrazole-4-nitrile, 3-Aminopyrazole-4-carbonitrile, 5-Aminopyrazole-4-carbonitrile, 153044_ALDRICH, Pyrazole-4-carbonitrile, 3-amino-, 5-amino-1H-pyrazole-4-carbonitrile, ZERO/001752, 3-Amino-1H-pyrazole-4-carbonitrile, BB_SC-3265, 1H-Pyrazole-4-carbonitrile, 3-amino-, NSC44932, EINECS 240-665-6, NSC 44932, ZINC01069844, TL8001275, AE-473/31199025, 103013-86-1

Molecular Formula: C4H4N4Molecular Weight: 108.101360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FFNKBQRKZRMYCL-UHFFFAOYSA-N

• 2-Amino-4-Methylthiazole
IUPAC Name: 4-methyl-1,3-thiazol-2-amine | CAS Registry Number: 1603-91-4
Synonyms: Normotiroide, 2-Amino-4-methylthiazole, 2-Thiazolamine, 4-methyl-, Thiazole, 2-amino-4-methyl-, 4-Methyl-2-aminothiazole, 4-Methyl-2-thiazolylamine, 4-Methylthiazol-2-ylamine, 4-METHYL-2-THIAZOLAMINE, A66006_ALDRICH, MLS000069416, 4-Methyl-1,3-thiazol-2-amine, NSC40462, EINECS 216-505-6, 2-AMINO-4-METHYLTHIAZOLE HCl, SBB004307, ZINC01508691, SMR000059048, AI3-61054, TL8001217, 24T

Molecular Formula: C4H6N2SMolecular Weight: 114.168840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OUQMXTJYCAJLGO-UHFFFAOYSA-N


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