Vitas-M small molecule compound

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

Catalog ID
STK085906
SMILES COc1cccc(c1)C(=O)N1N=C(CC1(O)C(F)(F)F)c1ccccc1

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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 C18H15F3N2O3 MW 364.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F3N2O3/c1-26-14-9-5-8-13(10-14)16(24)23-17(25,18(19,20)21)11-15(22-23)12-6-3-2-4-7-12/h2-10,25H,11H2,1H3
InChIKey
KALZVGUSNYIQRM-UHFFFAOYSA-N
Synonyms
372152-33-5
(3METHOXYPHENYL)(5OXIDANYL3PHENYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)METHANONE
(5HYDROXY3PHENYL5(TRIFLUOROMETHYL)2PYRAZOLIN1YL)(3METHOXYPHENYL)METHANONE
(5HYDROXY3PHENYL5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL1YL)(3METHOXYPHENYL)METHANONE
(5HYDROXY3PHENYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)(3METHOXYPHENYL)METHANONE
(5HYDROXY3PHENYL5TRIFLUOROMETHYL45DIHYDROPYRAZOL1YL)(3METHOXYPHENYL)METHANONE
372152335
COC1=CC=CC(=C1)C(=O)N2C(CC(=N2)C3=CC=CC=C3)(C(F)(F)F)O
COc1cccc(c1)C(=O)N1N=C(CC1(O)C(F)(F)F)c1ccccc1
InChI=1SC18H15F3N2O3c1261495813(1014)16(24)2317(2518(1920)21)1115(2223)126324712h21025H11H21H3
MFCD01878057
STK085906
ZINC000000910667
ZINC000000910669

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Available files

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