Vitas-M small molecule compound

methyl [1-(2,2-difluoroethyl)-3-methyl-6-oxo-4-(trifluoromethyl)-1,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]acetate

Catalog ID
STK351922
SMILES COC(=O)Cn1c(=O)cc(c2c1n(CC(F)F)nc2C)C(F)(F)F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H12F5N3O3 MW 353.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12F5N3O3/c1-6-11-7(13(16,17)18)3-9(22)20(5-10(23)24-2)12(11)21(19-6)4-8(14)15/h3,8H,4-5H2,1-2H3
InChIKey
KMCGNBCBADGYCA-UHFFFAOYSA-N
Synonyms
1018142-58-9
1018142589
CC1=NN(C2=C1C(=CC(=O)N2CC(=O)OC)C(F)(F)F)CC(F)F
InChI=1SC13H12F5N3O3c16117(13(1617)18)39(22)20(510(23)242)12(11)21(196)48(14)15h38H45H212H3
methyl(1(22difluoroethyl)3methyl6oxo4(trifluoromethyl)16dihydro7Hpyrazolo(34b)pyridin7yl)acetate
METHYL2(1(22DIFLUOROETHYL)3METHYL6OXO4(TRIFLUOROMETHYL)7HYDROPYRAZOLO(54B)PYRIDIN7YL)ACETATE
methyl2(1(22difluoroethyl)3methyl6oxo4(trifluoromethyl)pyrazolo(34b)pyridin7yl)acetate
MFCD09701555
ZINC000012396395
ZINC12396395

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Available files

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