Product Code
TRC-O865000
CAS Number
Product Format
Neat
Molecular Formula
C16 H13 F6 N5 O
Molecular Weight
405.30
API Family
SitagliptinProduct Categories
Product Type
ImpurityPurity
>95% (HPLC)
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Analyte Name
(2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)but-2-en-2-amine
CAS Number
767340-03-4
Molecular Formula
C16 H13 F6 N5 O
Molecular Weight
405.30
Accurate Mass
405.1024
Flash Point
4
SMILES
N\C(=C/C(=O)N1CCn2c(C1)nnc2C(F)(F)F)\Cc3cc(F)c(F)cc3F
InChI
InChI=1S/C16H13F6N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4-6H,1-3,7,23H2/b9-5-
IUPAC
(Z)-3-amino-1-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-4-(2,4,5-trifluorophenyl)but-2-en-1-one
Storage Temperature
+4°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Impurity
Product Format
Neat
Impurity Type
Intermediate
API Family
Purity
>95% (HPLC)
Sitagliptin intermediate. A dipeptidyl peptidase-4 inhibitor and an anti-hypertensive agent for the treatment of diabetes and hypertension.
References: Kim, D., et al.: J. Med. Chem., 48, 141 (2005), Ahren, B., et al.: Eur. J. Pharmacol., 521 164 (2005),
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![(2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifl](https://assets.lgcstandards.com/sys-master%2Fimages%2Fh36%2Fh5f%2F10587458928670%2F37694.png "(2Z)-4-Oxo-4-[3-(trifluoromethyl)-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifl - CAS No. 767340-03-4")