2-Oxo R-Clopidogrel

CAT: 1596-AR-C03292-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-C03292-01Size:10 Units

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CAS Number

1360923-54-1

Synonyms

(2R) -methyl 2- (2-chlorophenyl) -2- (2-oxo-7,7a-dihydrothieno[3,2-c]pyridin-5 (2H,4H,6H) -yl) acetate

Molecular Formula

C16H16ClNO3S

Molecular Weight

337.82

API Name

Clopidogrel

Chemical Information

Clopidogrel Impurity 86

CAS Number	1360923-54-1
PubChem CID	68264179
IUPAC Name	methyl (2R)-2-(2-chlorophenyl)-2-(2-oxo-4,6,7,7a-tetrahydrothieno[3,2-c]pyridin-5-yl)acetate
Molecular Formula	C16H16ClNO3S
Molecular Weight	337.8
XLogP	2.6
Topological Polar Surface Area	71.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	22
Formal Charge	0
Complexity	496

SMILES

COC(=O)[C@@H](C1=CC=CC=C1Cl)N2CCC3C(=CC(=O)S3)C2

InChI

InChI=1S/C16H16ClNO3S/c1-21-16(20)15(11-4-2-3-5-12(11)17)18-7-6-13-10(9-18)8-14(19)22-13/h2-5,8,13,15H,6-7,9H2,1H3/t13?,15-/m1/s1

InChIKey

JBSAZVIMJUOBNB-AWKYBWMHSA-N

Chemical Structure

2D Structure

CAS: 1360923-54-1

CID: 68264179

Formula: C16H16ClNO3S

MW: 337.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	337.8
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	337.0539422
Monoisotopic Mass	337.0539422
Topological Polar Surface Area	71.9 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	496
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-C03264-01	2-Oxo Clopidogrel (Mixture of Diastereomers)
AR-C03276-01	2-Oxo-Clopidogrel-d4 (Mixture of Diastereomers)
AR-C03277-01	(R) -Clopidogrel Carboxylic Acid
AR-C03293-01	R-Clopidogrel N-Oxide
AR-C08133-01	Clopidogrel Open Ring R-Enantiomer
AR-C03301-01	Clopidogrel EP Impurity E (R-Isomer)
AR-C03279-01	Clopidogrel Impurity 2 Bromide (Clopidogrel Iminium Impurity)
AR-C08128-01	Clopidogrel Impurity 2 Bromide (rac-Clopidogrel Iminium Impurity)
AR-P31418-01	(R) -3-Hydroxy-2-oxo-4-Phosphooxybutanoate
AR-C03285-01	Clopidogrel Impurity E (Clopidogrel Sulfonated Impurity)

Catalog	Name
HY-118025-01	(±) -2-Oxo clopidogrel
GTR19191846	2-oxo Clopidogrel
CS-T-94982	2-Oxo Clopidogrel-d3
OR1036662	(±) -2-Oxo clopidogrel (hydrochloride)
CS-T-60069	2-Oxo Clopidogrel Hydrochloride
HY-118025R	(±) -2-Oxo clopidogrel (Standard)
JEA90427-01	2-Oxo clopidogrel (Mixture of Isomers)
HY-W778270-01	2-Oxo clopidogrel-13C, d3 (hydrochloride)
018995	2-Oxo Clopidogrel Hydrochloride (Mixture of Diastereomers)
TRC-O869990-10MG	2-Oxo Clopidogrel Hydrochloride(Mixture of Diastereomers)