Vitas-M small molecule compound
3-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-5-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-2-hydroxy-4H-pyran-4-one
Catalog ID
STL311982
SMILES Oc1occ(c(=O)c1CN1CCN(CC1)Cc1ccc2c(c1)OCO2)CN1CCc2c(C1)cccc2
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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 C28H31N3O5 MW 489.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O5/c32-27-23(16-31-8-7-21-3-1-2-4-22(21)15-31)18-34-28(33)24(27)17-30-11-9-29(10-12-30)14-20-5-6-25-26(13-20)36-19-35-25/h1-6,13,18,33H,7-12,14-17,19H2InChIKey
HMFCKDLPPINNRB-UHFFFAOYSA-NSynonyms
3((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)5(34dihydroisoquinolin2(1H)ylmethyl)2hydroxy4Hpyran4one
3((4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)methyl)5((34dihydroisoquinolin2(1H)yl)methyl)2hydroxy4Hpyran4one
MFCD22584456
ZINC000101410818
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