Vitas-M small molecule compound
(2E)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one
Catalog ID
STK055470
SMILES COc1ccc(cc1)/C=C/C(=O)N1CCN(CC1)Cc1ccc2c(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 C22H24N2O4 MW 380.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O4/c1-26-19-6-2-17(3-7-19)5-9-22(25)24-12-10-23(11-13-24)15-18-4-8-20-21(14-18)28-16-27-20/h2-9,14H,10-13,15-16H2,1H3/b9-5+InChIKey
LKYSAUYVUVQAAC-WEVVVXLNSA-NSynonyms
(2E)1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)3(4METHOXYPHENYL)PROP2EN1ONE
(E)1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)3(4METHOXYPHENYL)PROP2EN1ONE
COC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4
COc1ccc(cc1)C=CC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2
InChI=1SC22H24N2O4c126196217(3719)5922(25)24121023(111324)1518482021(1418)28162720h2914H10131516H21H3b95+
MFCD02708911
STK055470
ZINC000020130896
ZINC20130896
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