Vitas-M small molecule compound

(4-bromophenyl)[5-hydroxy-3-(2-methylpropyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone

Catalog ID
STK396972
SMILES CC(CC1=NN(C(C1)(O)C(F)(F)F)C(=O)c1ccc(cc1)Br)C

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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 C15H16BrF3N2O2 MW 393.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16BrF3N2O2/c1-9(2)7-12-8-14(23,15(17,18)19)21(20-12)13(22)10-3-5-11(16)6-4-10/h3-6,9,23H,7-8H2,1-2H3
InChIKey
IQMYGOGPKBCAKI-UHFFFAOYSA-N
Synonyms

(4bromophenyl)(5hydroxy3(2methylpropyl)5(trifluoromethyl)45dihydro1Hpyrazol1yl)methanone
(4BROMOPHENYL)(5HYDROXY3(2METHYLPROPYL)5(TRIFLUOROMETHYL)4HPYRAZOL1YL)METHANONE
CC(C)CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)Br
InChI=1SC15H16BrF3N2O2c19(2)712814(2315(1718)19)21(2012)13(22)103511(16)6410h36923H78H212H3
MFCD02067888
ZINC000004503244
ZINC000004503245

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Available files

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