Organofluorine / Alfa Chemistry
Prasugrel

Prasugrel

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Prasugrel

Description: Prasugrel is a thienopyridine ADP receptor (P2Y12) antagonist, used for the reduction of thrombotic cardiovascular events.

Catalog OFC150322433
CAS 150322-43-3
Category Fluorinated APIs
Synonyms Effient
Purity >98%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name [5-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl] acetate
InChI InChI=1S/C20H20FNO3S/c1-12(23)25-18-10-14-11-22(9-8-17(14)26-18)19(20(24)13-6-7-13)15-4-2-3-5-16(15)21/h2-5,10,13,19H,6-9,11H2,1H3
InChI Key DTGLZDAWLRGWQN-UHFFFAOYSA-N
Isomeric SMILES CC(=O)OC1=CC2=C(S1)CCN(C2)C(C3=CC=CC=C3F)C(=O)C4CC4
EC Number 801-962-1
Molecular Formula C20H20FNO3S
Molecular Weight 373.44
Appearance White to off-white solid powder
XLogP3-AA 3.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 373.11479284 g/mol
Monoisotopic Mass 373.11479284 g/mol
Topological Polar Surface Area 74.8Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 555

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