Vitas-M small molecule compound

[5-hydroxy-5-(pyridin-4-yl)-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](3-methoxyphenyl)methanone

Catalog ID
STK756175
SMILES COc1cccc(c1)C(=O)N1N=C(CC1(O)c1ccncc1)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 C17H14F3N3O3 MW 365.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14F3N3O3/c1-26-13-4-2-3-11(9-13)15(24)23-16(25,12-5-7-21-8-6-12)10-14(22-23)17(18,19)20/h2-9,25H,10H2,1H3
InChIKey
UJLFWCCXPKZSMY-UHFFFAOYSA-N
Synonyms

(5hydroxy5(pyridin4yl)3(trifluoromethyl)45dihydro1Hpyrazol1yl)(3methoxyphenyl)methanone
(5HYDROXY5PYRIDIN4YL3(TRIFLUOROMETHYL)4HPYRAZOL1YL)(3METHOXYPHENYL)METHANONE
COC1=CC=CC(=C1)C(=O)N2C(CC(=N2)C(F)(F)F)(C3=CC=NC=C3)O
InChI=1SC17H14F3N3O3c1261342311(913)15(24)2316(251257218612)1014(2223)17(1819)20h2925H10H21H3
MFCD00782058
ZINC000000705318
ZINC000000705319

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.