Vitas-M small molecule compound

2-phenoxy-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}butan-1-one

Catalog ID
STK417456
SMILES CCC(C(=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F)Oc1ccccc1

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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 C21H23F3N2O2 MW 392.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23F3N2O2/c1-2-19(28-18-9-4-3-5-10-18)20(27)26-13-11-25(12-14-26)17-8-6-7-16(15-17)21(22,23)24/h3-10,15,19H,2,11-14H2,1H3
InChIKey
UGYJAMLTVYWVCZ-UHFFFAOYSA-N
Synonyms

2phenoxy1(4(3(trifluoromethyl)phenyl)piperazin1yl)butan1one
2PHENOXY1(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINYL)BUTAN1ONE
CCC(C(=O)N1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F)OC3=CC=CC=C3
InChI=1SC21H23F3N2O2c1219(281894351018)20(27)26131125(121426)1786716(1517)21(2223)24h3101519H21114H21H3
MFCD03396873
ZINC000004881606
ZINC000004881607

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Available files

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