Vitas-M small molecule compound
3-methyl-5-oxo-5-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pentanoic acid
Catalog ID
STK465414
SMILES CC(CC(=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F)CC(=O)O
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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 C17H21F3N2O3 MW 358.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21F3N2O3/c1-12(10-16(24)25)9-15(23)22-7-5-21(6-8-22)14-4-2-3-13(11-14)17(18,19)20/h2-4,11-12H,5-10H2,1H3,(H,24,25)InChIKey
KHTXRVHWAGYJEW-UHFFFAOYSA-NSynonyms
3methyl5oxo5(4(3(trifluoromethyl)phenyl)piperazin1yl)pentanoicacid
3METHYL5OXO5(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)PENTANOICACID
CC(CC(=O)N1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F)CC(=O)O
InChI=1SC17H21F3N2O3c112(1016(24)25)915(23)227521(6822)1442313(1114)17(1819)20h241112H510H21H3(H2425)
MFCD06065854
ZINC000017073913
ZINC000017073914
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