Vitas-M small molecule compound

2-(4-fluorophenyl)-5-methyl-4-(3-methylbutyl)-1,2-dihydro-3H-pyrazol-3-one

Catalog ID
STK626872
SMILES CC(CCc1c(C)[nH]n(c1=O)c1ccc(cc1)F)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 C15H19FN2O MW 262.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19FN2O/c1-10(2)4-9-14-11(3)17-18(15(14)19)13-7-5-12(16)6-8-13/h5-8,10,17H,4,9H2,1-3H3
InChIKey
GXDPVIMPKPZNTP-UHFFFAOYSA-N
Synonyms
925154-51-4
2(4fluorophenyl)5methyl4(3methylbutyl)12dihydro3Hpyrazol3one
2(4fluorophenyl)5methyl4(3methylbutyl)1Hpyrazol3one
925154514
CC(CCc1c(C)(nH)n(c1=O)c1ccc(cc1)F)C
CC1=C(C(=O)N(N1)C2=CC=C(C=C2)F)CCC(C)C
InChI=1SC15H19FN2Oc110(2)491411(3)1718(15(14)19)137512(16)6813h581017H49H213H3
MFCD18159189
ZINC000009937361
ZINC09937361
ZINC100072235
ZINC9937361

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Available files

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