Chemical identity

Prasugrel EP Impurity C / Prasugrel 4-Fluoro Impurity / p-Fluoro Prasugrel Hydrochloride

CAS 1391053-98-7 · C₂₀H₂₁ClFNO₃S

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-25782
PubChem CID71316879
NamePrasugrel EP Impurity C / Prasugrel 4-Fluoro Impurity / p-Fluoro Prasugrel Hydrochloride
CAS RN1391053-98-7
Molecular formulaC₂₀H₂₁ClFNO₃S
Molecular weight409.90 g/mol
IUPAC name2-[1-[2-Cyclopropyl-1-(4-fluorophenyl)-2-oxoethyl]-4-mercapto-3-piperidinylidene]acetic Acid Hydrochloride
InChIKeyVORROWWIWNJHRE-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 71316879
2D structure: Prasugrel EP Impurity C / Prasugrel 4-Fluoro Impurity / p-Fluoro Prasugrel Hydrochloride, CAS 1391053-98-7
Structure of Prasugrel EP Impurity C / Prasugrel 4-Fluoro Impurity / p-Fluoro Prasugrel Hydrochloride (CAS 1391053-98-7). LazyChem record. Source identity: PubChem CID 71316879. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC₂₀H₂₁ClFNO₃S
InChIKeyVORROWWIWNJHRE-UHFFFAOYSA-N
Ring count4
Defined stereocentres0
Unassigned stereocentres1
SMILESCC(=O)OC1=CC2=C(S1)CCN(C2)C(C3=CC=C(C=C3)F)C(=O)C4CC4.Cl
InChIInChI=1S/C20H20FNO3S.ClH/c1-12(23)25-18-10-15-11-22(9-8-17(15)26-18)19(20(24)14-2-3-14)13-4-6-16(21)7-5-13;/h4-7,10,14,19H,2-3,8-9,11H2,1H3;1H

03Stereochemistry

The published structure contains 0 defined and 1 unassigned tetrahedral stereocentre. The exact wedge-and-dash depiction is shown above.

Defined stereocentres02D structure
Unassigned stereocentres12D structure
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 1391053-98-7 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 1391053-98-7 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Prasugrel

View API and impurity family

Other names

  • Prasugrel EP Impurity C
  • Prasugrel 4-Fluoro Impurity / p-Fluoro Prasugrel
  • 2-[2-(Acetyloxy)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]-1-cyclopropyl-2-(4-fluorophenyl)ethanone Hydrochloride
  • p-Fluoro Prasugrel Hydrochloride
  • 5-(2-Cyclopropyl-1-(4-fluorophenyl)-2-oxoethyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl acetate hydrochloride
  • [5-[2-cyclopropyl-1-(4-fluorophenyl)-2-oxoethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridin-2-yl] acetate
  • hydrochloride
  • A1-01760

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources