Vitas-M small molecule compound
2-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethoxy}-7,8,9,10-tetrahydroazepino[2,1-b]quinazolin-12(6H)-one
Catalog ID
STL350823
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1
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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 C27H30N4O5 MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O5/c32-26(30-12-10-29(11-13-30)16-19-5-8-23-24(14-19)36-18-35-23)17-34-20-6-7-22-21(15-20)27(33)31-9-3-1-2-4-25(31)28-22/h5-8,14-15H,1-4,9-13,16-18H2InChIKey
IRXBXHMDOAALQX-UHFFFAOYSA-NSynonyms
951951-63-62(2(4(13benzodioxol5ylmethyl)piperazin1yl)2oxoethoxy)78910tetrahydro6Hazepino(21b)quinazolin12one
2(2(4(13benzodioxol5ylmethyl)piperazin1yl)2oxoethoxy)78910tetrahydroazepino(21b)quinazolin12(6H)one
2(2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)2oxoethoxy)78910tetrahydroazepino(21b)quinazolin12(6H)one
951951636
C1CCC2=NC3=C(C=C(C=C3)OCC(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6)C(=O)N2CC1
InChI=1SC27H30N4O5c3226(30121029(111330)1619582324(1419)36183523)173420672221(1520)27(33)319312425(31)2822h581415H149131618H2
MFCD09851653
ZINC000013690303
ZINC13690303
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