Vitas-M small molecule compound
3-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-7,8-dimethoxy-5-methyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Catalog ID
STL312531
SMILES COc1cc2c(cc1OC)c1c(n2C)c(=O)n(nc1)CN1CCN(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 C26H29N5O5 MW 491.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N5O5/c1-28-20-12-23(34-3)22(33-2)11-18(20)19-13-27-31(26(32)25(19)28)15-30-8-6-29(7-9-30)14-17-4-5-21-24(10-17)36-16-35-21/h4-5,10-13H,6-9,14-16H2,1-3H3InChIKey
OBZHOVFPGWKSPD-UHFFFAOYSA-NSynonyms
1401591-38-51401591385
3((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)78dimethoxy5methyl35dihydro4Hpyridazino(45b)indol4one
3((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)78dimethoxy5methylpyridazino(45b)indol4one
3((4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)methyl)78dimethoxy5methyl3Hpyridazino(45b)indol4(5H)one
CN1C2=CC(=C(C=C2C3=C1C(=O)N(N=C3)CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6)OC)OC
InChI=1SC26H29N5O5c128201223(343)22(332)1118(20)19132731(26(32)25(19)28)15308629(7930)1417452124(1017)36163521h451013H691416H213H3
MFCD22582544
ZINC000079477933
ZINC79477933
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