Products 823817-56-7

CAS 823817-56-7 appears in our catalog under these names: Sitagliptin impurity E, (Rac)-Sitagliptin. Offered by: Biosynth, MedChemExpress. Available pack sizes: 1g, 2g, 5g, 10g, 100 mg, 50 mg, 10 mg, 5 mg.

Sitagliptin impurity E
Biosynth
  • size: 1g, 2g, 5g, 10g
  • Variants: 4
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(Rac)-Sitagliptin
MedChemExpress
  • size: 100 mg, 50 mg, 10 mg, 5 mg
  • Variants: 5
from 407.93
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Structural formula: {0} (CAS {1})

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 (CAS 823817-56-7) is a chemical compound with the molecular formula C16H15F6N5O and a molecular weight of 407.31 g/mol. IUPAC name: 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. InChIKey: MFFMDFFZMYYVKS-UHFFFAOYSA-N.

Identity
Molecular formulaC16H15F6N5O
Molecular weight407.31 g/mol
IUPAC name3-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
InChIKeyMFFMDFFZMYYVKS-UHFFFAOYSA-N
SMILESC1CN2C(=NN=C2C(F)(F)F)CN1C(=O)CC(CC3=CC(=C(C=C3F)F)F)N

Computed by PubChem (NCBI)

Synonyms: rac-Sitagliptin, (Rac)-Sitagliptin, (?)-Sitagliptin-d4 (hydrochloride), Rac Sitagliptin, Sitagliptin impurity E, Discontinued, see S491045, orb3143342
Related forms of this compound
(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 C16H15F6N5O
(3S)-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 C16H15F6N5O
Isomers (same molecular formula)
(3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,3,5-trifluorophenyl)butan-1-one C16H15F6N5O
(3R)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,3,6-trifluorophenyl)butan-1-one C16H15F6N5O