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Clopidogrel hydrogen sulfate

CAT: 0931-T0182L-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T0182L-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
120202-66-6
Target
Cytochromes P450, P2Y Receptor
Related Pathways
GPCR/G Protein, Metabolism, Neuroscience
Purity
0.9979
Bioactivity
Clopidogrel hydrogen sulfate ((S) - (+) -Clopidogrel bisulfate), a selective, high-affinity P2Y12 receptor antagonist, suppressess fibrinogen binding to platelets and platelet adhesion and aggregation.
Smiles
OS(O)(=O)=O.COC(=O)[C@@H](N1CCc2sccc2C1)c1ccccc1Cl
Molecular Formula
C16H16ClNO2S·H2SO4
Molecular Weight
419.9
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Clopidogrel Bisulfate

Clopidogrel Bisulfate is a thienopyridine with antiplatelet activity. Clopidogrel bisulfate irreversibly alters the platelet receptor for adenosine diphosphate (ADP), thereby blocking the binding of ADP to its receptor, inhibiting ADP-mediated activation of the glycoprotein complex GPIIb/IIIa, and inhibiting fibrinogen binding to platelets and platelet adhesion and aggregation. (NCI04)

CAS Number120202-66-6
PubChem CID115366
IUPAC Namemethyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate;sulfuric acid
Molecular FormulaC16H18ClNO6S2
Molecular Weight419.9
Topological Polar Surface Area141
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity463
SMILES
COC(=O)[C@H](C1=CC=CC=C1Cl)N2CCC3=C(C2)C=CS3.OS(=O)(=O)O
InChI
InChI=1S/C16H16ClNO2S.H2O4S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14;1-5(2,3)4/h2-5,7,9,15H,6,8,10H2,1H3;(H2,1,2,3,4)/t15-;/m0./s1
InChIKey
FDEODCTUSIWGLK-RSAXXLAASA-N
Chemical Structure
2D Structure
2D structure of Clopidogrel Bisulfate
CAS: 120202-66-6
CID: 115366
Formula: C16H18ClNO6S2
MW: 419.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight419.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass419.0264073
Monoisotopic Mass419.0264073
Topological Polar Surface Area141 Ų
Heavy Atom Count26
Formal Charge0
Complexity463
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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