Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]prop-2-en-1-one
Catalog ID
STK028503
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)/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 C22H22N2O5 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5/c25-22(6-3-16-1-4-18-20(11-16)28-14-26-18)24-9-7-23(8-10-24)13-17-2-5-19-21(12-17)29-15-27-19/h1-6,11-12H,7-10,13-15H2/b6-3+InChIKey
KNCDCPNZLUQYET-ZZXKWVIFSA-NSynonyms
349541-68-0(2E)3(13BENZODIOXOL5YL)1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)PROP2EN1ONE
(2E)3(2HBENZO(D)13DIOXOLAN5YL)1(4(2HBENZO(D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)PROP2EN1ONE
(E)3(13benzodioxol5yl)1(4(13benzodioxol5ylmethyl)piperazin1yl)prop2en1one
(E)3(benzo(d)(13)dioxol5yl)1(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)prop2en1one
349541680
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C=CC4=CC5=C(C=C4)OCO5
InChI=1SC22H22N2O5c2522(6316141820(1116)28142618)249723(81024)1317251921(1217)29152719h161112H7101315H2b63+
MFCD02736147
O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)C=Cc1ccc2c(c1)OCO2
STK028503
ZINC000013425502
ZINC13425502
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