Vitas-M small molecule compound
4-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-6-hydroxy-2H-chromen-2-one
Catalog ID
STK921917
SMILES Oc1ccc2c(c1)c(CN1CCN(CC1)Cc1ccc3c(c1)OCO3)cc(=O)o2
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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/c25-17-2-4-19-18(11-17)16(10-22(26)29-19)13-24-7-5-23(6-8-24)12-15-1-3-20-21(9-15)28-14-27-20/h1-4,9-11,25H,5-8,12-14H2InChIKey
ITQQNPNTVSMNCB-UHFFFAOYSA-NSynonyms
859862-56-94((4(13benzodioxol5ylmethyl)piperazin1ium1yl)methyl)2oxochromen6olate
4((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)6hydroxy2Hchromen2one
4((4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)METHYL)6HYDROXYCHROMEN2ONE
4((4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)METHYL)6HYDROXYCHROMEN2ONE
4((4(BENZO(D)(13)DIOXOL5YLMETHYL)PIPERAZIN1YL)METHYL)6HYDROXY2HCHROMEN2ONE
C1CN(CC(NH+)1CC2=CC(=O)OC3=C2C=C(C=C3)(O))CC4=CC5=C(C=C4)OCO5
InChI=1SC22H22N2O5c2517241918(1117)16(1022(26)2919)13247523(6824)1215132021(915)28142720h1491125H581214H2
ZINC19370017
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