Vitas-M small molecule compound

(2E)-3-(4-chlorophenyl)-N-{4-[4-(pentafluorophenyl)piperazin-1-yl]phenyl}prop-2-enamide

Catalog ID
STK389482
SMILES O=C(Nc1ccc(cc1)N1CCN(CC1)c1c(F)c(F)c(c(c1F)F)F)/C=C/c1ccc(cc1)Cl

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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 C25H19ClF5N3O MW 507.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClF5N3O/c26-16-4-1-15(2-5-16)3-10-19(35)32-17-6-8-18(9-7-17)33-11-13-34(14-12-33)25-23(30)21(28)20(27)22(29)24(25)31/h1-10H,11-14H2,(H,32,35)/b10-3+
InChIKey
HZWBPLSFJLYWIG-XCVCLJGOSA-N
Synonyms

(2E)3(4chlorophenyl)N(4(4(pentafluorophenyl)piperazin1yl)phenyl)prop2enamide
(E)3(4chlorophenyl)N(4(4(23456pentafluorophenyl)piperazin1yl)phenyl)prop2enamide
C1CN(CCN1C2=CC=C(C=C2)NC(=O)C=CC3=CC=C(C=C3)Cl)C4=C(C(=C(C(=C4F)F)F)F)F
InChI=1SC25H19ClF5N3Oc26164115(2516)31019(35)32176818(9717)33111334(141233)2523(30)21(28)20(27)22(29)24(25)31h110H1114H2(H3235)b103+
MFCD03836165
O=C(Nc1ccc(cc1)N1CCN(CC1)c1c(F)c(F)c(c(c1F)F)F)C=Cc1ccc(cc1)Cl
ZINC000004122172
ZINC04122172
ZINC4122172

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Available files

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