Chemical identity

Sitagliptin Styrylacetyl Analog/ 3-Desamino-3,4-Dehydro Sitagliptin/ Sitagliptin 3-En Analog/ Sitagliptin FP Impurity C

CAS 1803026-58-5 · C16H12F6N4O

01Identity

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

Lazychem IDLC-28181
PubChem CID125366354
NameSitagliptin Styrylacetyl Analog/ 3-Desamino-3,4-Dehydro Sitagliptin/ Sitagliptin 3-En Analog/ Sitagliptin FP Impurity C
CAS RN1803026-58-5
Molecular formulaC16H12F6N4O
Molecular weight390.28 g/mol
IUPAC name(E)-1-(3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-4-(2,4,5-trifluorophenyl)but-3-en-1-one
InChIKeyBLDAVCZELRQXFP-OWOJBTEDSA-N

02Structure identifiers

2D structurePubChem CID 125366354
Two-dimensional chemical structure of Sitagliptin Styrylacetyl Analog/ 3-Desamino-3,4-Dehydro Sitagliptin/ Sitagliptin 3-En Analog/ Sitagliptin FP Impurity C, CAS 1803026-58-5
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 3 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres0
Unassigned stereocentres0
Ring count3
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESC1CN2C(=NN=C2C(F)(F)F)CN1C(=O)C/C=C/C3=CC(=C(C=C3F)F)F
InChINot listed
Formula from structureC16H12F6N4O
Molecular weight from structure390.28 g/mol

03India 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 / RCSNO EXACT MATCH FOUNDCAS 1803026-58-5 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 1803026-58-5 has no exact match in the reviewed SCOMET list.
Review date2026-08-01Recheck the current official instruments for the material, concentration, activity and date in question.

04Names and relationships

Associated parent compound

Sitagliptin

View API and impurity family

Other names

  • Sitagliptin Styrylacetyl Analog
  • 3-Desamino-3,4-Dehydro Sitagliptin
  • Sitagliptin 3-En Analog
  • Sitagliptin FP Impurity C

Related records from the same parent family

05Documented 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.

06Sources