| CAS Number | 1421283-60-4 |
| Catalog Number | AG001HTZ(AGN-PC-0WH3RV) |
| Chemical Name | (R)-1-(2-Chlorophenyl)-2-methoxy-2-oxoethyl (R)-2-(2-chlorophenyl)-2-(6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl)acetate |
| IUPAC Name | [(1R)-1-(2-chlorophenyl)-2-methoxy-2-oxoethyl] (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate |
| InChI | InChI=1S/C24H21Cl2NO4S/c1-30-24(29)22(17-7-3-5-9-19(17)26)31-23(28)21(16-6-2-4-8-18(16)25)27-12-10-20-15(14-27)11-13-32-20/h2-9,11,13,21-22H,10,12,14H2,1H3/t21-,22+/m0/s1 |
| InChI Key | WYMQFSIDOUJQGN-FCHUYYIVSA-N |
| MDL Number | MFCD28358804 |
| Molecular Formula | C24H21Cl2NO4S |
| Molecular Weight | 490.3988 |
| SMILES | ClC1=C(C=CC=C1)[C@H](C(=O)O[C@@H](C(=O)OC)C1=C(C=CC=C1)Cl)N1CC2=C(CC1)SC=C2 |
| Synonyms | 1421283-60-4,
Clopidogrel Carboxylic Acid [Methyl (R)-o-chloromandelate] Ester,
ACN-026587,
methyl (2R)-(2-chlorophenyl)[(2S)-(2-chlorophenyl)[6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ac etyl oxy]acetate,
Thieno[3,2-c]pyridine-5(4H)-acetic acid, alpha-(2-chlorophenyl)-6,7-dihydro-, (1R)-1-(2-chlorophenyl)-2-methoxy-2-oxoethyl ester, (alphaS)-,
Clopidogrel Impurity D,
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| Complexity | 668 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 489.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 32 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 490.395g/mol |
| Monoisotopic Mass | 489.057g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 84.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number