Vitas-M small molecule compound

6-phenyl-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrimidin-4(3H)-one

Catalog ID
STK277351
SMILES O=c1cc(nc([nH]1)N1CCN(CC1)c1cccc(c1)C(F)(F)F)c1ccccc1

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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 C21H19F3N4O MW 400.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19F3N4O/c22-21(23,24)16-7-4-8-17(13-16)27-9-11-28(12-10-27)20-25-18(14-19(29)26-20)15-5-2-1-3-6-15/h1-8,13-14H,9-12H2,(H,25,26,29)
InChIKey
JUXAOYHULHBLTK-UHFFFAOYSA-N
Synonyms

6phenyl2(4(3(trifluoromethyl)phenyl)piperazin1yl)1Hpyrimidin4one
6phenyl2(4(3(trifluoromethyl)phenyl)piperazin1yl)pyrimidin4(3H)one
6PHENYL2(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZINO)PYRIMIDINE4(3H)ONE
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=NC(=O)C=C(N3)C4=CC=CC=C4
InChI=1SC21H19F3N4Oc2221(2324)1674817(1316)2791128(121027)202518(1419(29)2620)155213615h181314H912H2(H252629)
MFCD09268941
O=c1cc(nc((nH)1)N1CCN(CC1)c1cccc(c1)C(F)(F)F)c1ccccc1
ZINC000009095237
ZINC09095237
ZINC9095237

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Available files

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