Vitas-M small molecule compound

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

Catalog ID
STK096744
SMILES COc1cc(/C=C/C(=O)N2CCN(CC2)c2ccc(cc2)F)cc(c1OC)OC

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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 C22H25FN2O4 MW 400.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25FN2O4/c1-27-19-14-16(15-20(28-2)22(19)29-3)4-9-21(26)25-12-10-24(11-13-25)18-7-5-17(23)6-8-18/h4-9,14-15H,10-13H2,1-3H3/b9-4+
InChIKey
HLCDAFODXKFJNX-RUDMXATFSA-N
Synonyms
432514-89-1
(2E)1(4(4FLUOROPHENYL)PIPERAZIN1YL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
(2E)1(4(4FLUOROPHENYL)PIPERAZINYL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)1(4(4FLUOROPHENYL)PIPERAZIN1YL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
432514891
COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCN(CC2)C3=CC=C(C=C3)F
COc1cc(C=CC(=O)N2CCN(CC2)c2ccc(cc2)F)cc(c1OC)OC
InChI=1SC22H25FN2O4c127191416(1520(282)22(19)293)4921(26)25121024(111325)187517(23)6818h491415H1013H213H3b94+
MFCD03348349
STK096744
ZINC000001150136
ZINC01150136
ZINC1150136

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Available files

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