Clopidogrel EP Impurity B

CAT: 1299-RM-C160702-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-C160702-02Size:25 mg

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CAS Number

1396841-05-6

Synonyms

Methyl (S) -2- (2-chlorophenyl) -2- (4,7-dihydrothieno[2,3-c]pyridin-6 (5H) -yl) acetate

Molecular Formula

C16H16ClNO2S

Molecular Weight

321.82

Target Alternative Name

Clopidogrel

Product Name Synonym

Methyl (S) -2- (2-chlorophenyl) -2- (4,7-dihydrothieno[2,3-c]pyridin-6 (5H) -yl) acetate

Chemical Information

Clopidogrel EP Impurity B

CAS Number	1396841-05-6
PubChem CID	49849329
IUPAC Name	methyl (2S)-2-(2-chlorophenyl)-2-(5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)acetate
Molecular Formula	C16H16ClNO2S
Molecular Weight	321.8
XLogP	3.8
Topological Polar Surface Area	57.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	21
Formal Charge	0
Complexity	381

SMILES

COC(=O)[C@H](C1=CC=CC=C1Cl)N2CCC3=C(C2)SC=C3

InChI

InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-11-7-9-21-14(11)10-18/h2-5,7,9,15H,6,8,10H2,1H3/t15-/m0/s1

InChIKey

ZEIGZKQSYIWMTR-HNNXBMFYSA-N

Chemical Structure

2D Structure

CAS: 1396841-05-6

CID: 49849329

Formula: C16H16ClNO2S

MW: 321.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	321.8
XLogP3	3.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	321.0590276
Monoisotopic Mass	321.0590276
Topological Polar Surface Area	57.8 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	381
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-C160701-01	Clopidogrel EP Impurity A
RM-C160713-01	Clopidogrel EP Impurity F
RM-C160704-01	Clopidogrel EP Impurity D
RM-C160703-01	Clopidogrel EP Impurity C
RM-C160730-01	Clopidogrel EP Impurity E; Clopidogrel Amide Racemate
RM-C160709-01	Clopidogrel EP Impurity A (R-Isomer) ((R) -Clopidogrel Carboxylic Acid)
RM-I140401-01	Indometacin EP Impurity A; Bezafibrate EP Impurity B; Acemetacin EP Impurity A; Clopamide EP Impurity B
RM-C061202-01	Cefalexin EP Impurity B; Cefadroxil EP Impurity B; Cefradine EP Impurity A
RM-O132302-01	Omeprazole EP Impurity B; Esomeprazole EP Impurity B
RG-C180501-01	Amylmetacresol EP Impurity B; Metacresol EP Impurity B

Catalog	Name
OR1042689-01	Clopidogrel IMpurity 2 (Clopidogrel IMiniuM IMpurity)
AR-C03285-01	Clopidogrel Impurity E (Clopidogrel Sulfonated Impurity)
IC158706-01	Clopidogrel Impurity A
AR-C03279-01	Clopidogrel Impurity 2 Bromide (Clopidogrel Iminium Impurity)
AR-C08128-01	Clopidogrel Impurity 2 Bromide (rac-Clopidogrel Iminium Impurity)
HY-Z4468-01	Clopidogrel impurity 3
AR-C05440-01	Clopidogrel Nitroso Impurity
AR-C03304-01	Clopidogrel Impurity 19
AR-C03300-01	Clopidogrel Impurity 13
AR-C03294-01	Clopidogrel Impurity 10