Vitas-M small molecule compound
2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]butan-1-one
Catalog ID
STL401494
SMILES CCC(n1nc(c(c1C)Br)C)C(=O)N1N=CCC1(O)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 C13H16BrF3N4O2 MW 397.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16BrF3N4O2/c1-4-9(20-8(3)10(14)7(2)19-20)11(22)21-12(23,5-6-18-21)13(15,16)17/h6,9,23H,4-5H2,1-3H3InChIKey
ZNAZRCMTGQELQR-UHFFFAOYSA-NSynonyms
1005554-31-31005554313
2(4bromo35dimethyl1Hpyrazol1yl)1(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)butan1one
2(4bromo35dimethylpyrazol1yl)1(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)butan1one
CCC(C(=O)N1C(CC=N1)(C(F)(F)F)O)N2C(=C(C(=N2)C)Br)C
InChI=1SC13H16BrF3N4O2c149(208(3)10(14)7(2)1920)11(22)2112(23561821)13(1516)17h6923H45H213H3
MFCD04059365
ZINC000006488991
ZINC000006489488
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Check stock on Vitas-MAvailable files
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