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Structure

Prasugrel metabolite

CAS
239466-74-1
Catalog Number
ACM239466741
Category
Other Products
Molecular Weight
349.42
Molecular Formula
C18H20FNO3S

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Specification

Synonyms
Prasugrel metabolite;trans-R-138727;trans-R-138727, Prasugrel Thio Acid metabolite;trans R-138727, (Prasugrel Metabolite) Hydrochloride(Mixture of Diastereomers) Discontinued
IUPAC Name
(2Z)-2-[1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4-sulfanylpiperidin-3-ylidene]acetic acid
Canonical SMILES
C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC(C(=CC(=O)O)C3)S
InChI Key
ZWUQVNSJSJHFPS-XFXZXTDPSA-N
Boiling Point
513.424ºC at 760 mmHg
Flash Point
264.31ºC
Density
1.34g/cm³
Exact Mass
349.11500
H-Bond Acceptor
5
H-Bond Donor
1
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