Products 486459-71-6

CAS 486459-71-6 appears in our catalog under these names: Sitagliptin monohydrochloride, 98%, 98%, Sitagliptin (hydrochloride). Offered by: Chemat, MedChemExpress. Available pack sizes: 1g, 5g, Get quote.

Sitagliptin monohydrochloride, 98%, 98%
Chemat
  • size: 1g, 5g
  • Variants: 2
from 338.00
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Sitagliptin (hydrochloride)
MedChemExpress
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  • Variants: 1
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Structural formula: {0} (CAS {1})

(3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;hydrochloride (CAS 486459-71-6) is a chemical compound with the molecular formula C16H16ClF6N5O and a molecular weight of 443.77 g/mol. IUPAC name: (3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;hydrochloride. InChIKey: PNXSHNOORJKXDW-SBSPUUFOSA-N.

Identity
Molecular formulaC16H16ClF6N5O
Molecular weight443.77 g/mol
IUPAC name(3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;hydrochloride
InChIKeyPNXSHNOORJKXDW-SBSPUUFOSA-N
SMILESC1CN2C(=NN=C2C(F)(F)F)CN1C(=O)C[C@@H](CC3=CC(=C(C=C3F)F)F)N.Cl

Computed by PubChem (NCBI)

Synonyms: Sitagliptin Hydrochloride, Sitagliptin monohydrochloride, Sitagliptin HCl, Sitagliptin hydrochloride [WHO-DD], SITAGLIPTIN HYDROCHLORIDE ANHYDROUS
Related forms of this compound
3-amino-1-[5,5,6,6-tetradeuterio-3-(trifluoromethyl)-8H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;hydrochloride C16H16ClF6N5O
3-amino-1-[5,5,6,6-tetradeuterio-3-(trifluoromethyl)-8H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)butan-1-one;hydrochloride C16H16ClF6N5O