Vitas-M small molecule compound

(2E)-3-(1,3-benzodioxol-5-yl)-1-[4-(2-fluorophenyl)piperazin-1-yl]prop-2-en-1-one

Catalog ID
STK025841
SMILES O=C(N1CCN(CC1)c1ccccc1F)/C=C/c1ccc2c(c1)OCO2

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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 C20H19FN2O3 MW 354.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19FN2O3/c21-16-3-1-2-4-17(16)22-9-11-23(12-10-22)20(24)8-6-15-5-7-18-19(13-15)26-14-25-18/h1-8,13H,9-12,14H2/b8-6+
InChIKey
UVXBLZSCQSUNDZ-SOFGYWHQSA-N
Synonyms
1164468-83-0
(2E)3(13BENZODIOXOL5YL)1(4(2FLUOROPHENYL)PIPERAZIN1YL)PROP2EN1ONE
(2E)3(2HBENZO(34D)13DIOXOLAN5YL)1(4(2FLUOROPHENYL)PIPERAZINYL)PROP2EN1ONE
(E)3(13BENZODIOXOL5YL)1(4(2FLUOROPHENYL)PIPERAZIN1YL)PROP2EN1ONE
1(3(13BENZODIOXOL5YL)ACRYLOYL)4(2FLUOROPHENYL)PIPERAZINE
1164468830
C1CN(CCN1C2=CC=CC=C2F)C(=O)C=CC3=CC4=C(C=C3)OCO4
InChI=1SC20H19FN2O3c2116312417(16)2291123(121022)20(24)8615571819(1315)26142518h1813H91214H2b86+
MFCD03144812
O=C(N1CCN(CC1)c1ccccc1F)C=Cc1ccc2c(c1)OCO2
STK025841
ZINC000001151427
ZINC01151427
ZINC1151427

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Available files

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