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Clopidogrel

PubChem CID: 60606

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Compound Synonyms clopidogrel, 113665-84-2, Zyllt, (S)-Clopidogrel, Thrombo, Plavix, (+)-Clopidogrel, (+)-(S)-Clopidogrel, Clopidogrel bisulfate, CLOPIDOGREL SULFATE, Clopidogrel Winthrop, Clopidogrel 1A Pharma, HSDB 7430, SR 25990, UNII-A74586SNO7, R 130964, CHEBI:37941, A74586SNO7, Clopidogrel Teva (hydrogen sulphate), methyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate, NSC-758613, Clopidogrelum, SR-25990, DTXSID6022848, R-130964, (S)-Methyl 2-(2-chlorophenyl)-2-(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetate, NSC 758613, Thieno[3,2-c]pyridine-5(4H)-acetic acid, alpha-(2-chlorophenyl)-6,7-dihydro-, methyl ester, (alphaS)-, Clopidogrel (TN), Plavix (TN), SR-25990C, methyl (2S)-(2-chlorophenyl)(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)ethanoate, methyl (2S)-2-(2-chlorophenyl)-2-{4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetate, Methyl 2-(2-chlorophenyl)-2-(4,5,6,7-tetrahydrothieno(3,2-c)pyridin-5-yl)acetate, Thieno(3,2-c)pyridine-5(4H)-acetic acid, alpha-(2-chlorophenyl)-6,7-dihydro-, methyl ester, (S)-, Clopidogrel [INN:BAN], CHEMBL1083385, methyl (2S)-(2-chlorophenyl)(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetate, SMR000550475, Plavix&reg, (+) clopidogrel, methyl (2S)-(2-chlorophenyl)(6,7-dihydrothieno(3,2-c)pyridin-5(4H)-yl)acetate, CGE, MFCD05662337, Clopidogrel (Standard), Spectrum_000105, CPD000550475, Clopidogrel (USP/INN), CLOPIDOGREL [MI], Spectrum2_000512, Spectrum3_001606, Spectrum4_000175, CLOPIDOGREL [INN], (+)-Methyl-alpha-5-, CLOPIDOGREL [HSDB], CLOPIDOGREL [VANDF], SCHEMBL4769, CHEMBL1771, BSPBio_003211, CLOPIDOGREL [WHO-DD], KBioGR_000689, KBioSS_000545, MLS001165708, MLS001195633, MLS001304711, MLS006011891, BIDD:GT0284, DivK1c_000787, SPBio_000463, CLOPIDOGREL [EMA EPAR], DTXCID202848, GTPL7150, HMS502H09, KBio1_000787, KBio2_000545, KBio2_003113, KBio2_005681, KBio3_002431, B01AC04, NINDS_000787, GLXC-01987, HMS2090O21, HMS2234N16, HMS3259B08, HMS3715J08, (+)-(S)-Methyl 2-(2-chlorophenyl)-2-(4,5,6,7-tetrahydrothieno[3,2-c ] pyridin-5-yl) acetate monosulfate, BBL010770, BDBM50318910, BDBM50397662, HY-15283R, NSC748298, STK580572, AKOS005504280, CCG-221243, CS-0656, DB00758, FM61519, NC00703, NSC-748298, IDI1_000787, Methyl (+)-(S)-alpha-(o-chlorophenyl)-6,7-dihydrothieno(3,2-c)pyridine-5(4H)-acetate, NCGC00163329-02, NCGC00163329-04, AC-19024, DS-13362, HY-15283, SBI-0052755.P002, NS00098635, D07729, N11780, AB00053786-07, AB00053786-08, AB00053786_09, AB00053786_10, EN300-7388859, Q410237, (alphaS)-alpha-(2-Chlorophenyl)-6,7-dihydrothieno, BRD-K27721098-065-02-9, BRD-K27721098-065-05-2, BRD-K27721098-065-08-6, BRD-K27721098-065-09-4, BRD-K27721098-065-10-2, Methyl (+)-(S)-alpha-(o-chlorophenyl)-6,7dihydrothieno, methyl (2-chlorophenyl)(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetate, (+)-(s)-methyl 2-(2-chlorophenyl)-2-(6,7-dihydrothieno[3,2-c]pyridin-5(4h)-yl)acetate, (S)-(+)-Methyl (2-chlorophenyl)(6,7-dihydro-4H-thieno[3,2-c]pyrid-5-yl)acetate, (S)-(+)-Methyl (2-chlorophenyl)-(6,7-dihydro-4H-thieno[3,2-c]pyrid-5-yl)acetate, (S)-Methyl2-(2-chlorophenyl)-2-(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetate, methyl (+)-(S)-alpha-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine-5(4H)-acetate, methyl (+)-(s)-alpha-(o-chlorophenyl)-6,7-dihydrothieno-[3,2-c]pyridine-5(4h)-acetate, Methyl (2S)-(2-chlorophenyl)(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetate sulfate, methyl (2S)-2-(2-chlorophenyl)-2-(9-thia-4-azabicyclo[4.3.0]nona-7,10-dien-4-yl)acetate, methyl (S)-(+)-alpha-(o-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-acetate, methyl(+)-(s)-alpha-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine-5(4h) acetate, methyl-(S)-(+)-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-yl)-acetate, (+)-(S)-(2-Chlorophenyl) (6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetic acid methyl ester, (+)-(S)-2-(2-chlorophenyl)-(6,7-dihydro-4H-thieno[3,2-c]pyrid-5-yl)acetic acid methyl ester, (S)-METHYL .ALPHA.-(4,5,6,7-TETRAHYDROTHIENO(3,2-C)PYRIDIN-5-YL)-.ALPHA.-(O-CHLOROPHENYL)ACETATE, (S)-METHYL alpha-(4,5,6,7-TETRAHYDROTHIENO(3,2-C)PYRIDIN-5-YL)-alpha-(O-CHLOROPHENYL)ACETATE, Thieno[3,2-c]pyridine-5(4H)-acetic acid, .alpha.-(2-chlorophenyl)-6,7-dihydro-, methyl ester, (.alpha.S)-
Topological Polar Surface Area 57.8
Hydrogen Bond Donor Count 0.0
Heavy Atom Count 21.0
Description Clopidogrel is a potent oral antiplatelet agent often used in the treatment of coronary artery disease, peripheral vascular disease, and cerebrovascular disease. It is marketed by Bristol-Myers Squibb and Sanofi-Aventis under the trade name Plavix. -- Wikipedia, Clopidogrel is a potent oral antiplatelet agent often used in the treatment of coronary artery disease, peripheral vascular disease, and cerebrovascular disease. It is marketed by Bristol-Myers Squibb and Sanofi-Aventis under the trade name Plavix. It is also marketed in the generic form by Apotex, a large Canadian generic pharmaceutical company, though an injunction to withhold further shipments of their form is in effect while patent issues are dealt with. In 2005 it was the world's second highest selling pharmaceutical with sales of US$5.9 billion. [HMDB]
Isotope Atom Count 0.0
Molecular Complexity 381.0
Database Name cmaup_ingredients;fooddb_chem_all;pubchem
Defined Atom Stereocenter Count 1.0
Enzyme Uniprot Id P16109, Q9H244
Iupac Name methyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate
Prediction Hob 1.0
Target Id NPT627, NPT213
Xlogp 3.8
Molecular Formula C16H16ClNO2S
Prediction Swissadme 1.0
Inchi Key GKTWGGQPFAXNFI-HNNXBMFYSA-N
Fcsp3 0.3125
Logs -3.139
Rotatable Bond Count 4.0
State Solid
Logd 3.489
Synonyms (+)-(S)-Clopidogrel, (+)-Clopidogrel, (S)-Clopidogrel, Clopidogrel, Clopidogrel bisulfate, Clopidogrel bisulphate, Clopidogrelum, Isocover, Plavix
Compound Name Clopidogrel
Prediction Hob Swissadme 1.0
Exact Mass 321.059
Formal Charge 0.0
Monoisotopic Mass 321.059
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 321.8
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Esol -4.321458847619047
Inchi InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3/t15-/m0/s1
Smiles COC(=O)[C@H](C1=CC=CC=C1Cl)N2CCC3=C(C2)C=CS3
Nring 3.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Morus Australis (Plant) Rel Props:Source_db:cmaup_ingredients
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