Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-11-(3,5-dimethylphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL338733
SMILES Cc1cc(C)cc(c1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)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 C29H23N5O3 MW 489.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5O3/c1-16-10-17(2)12-20(11-16)34-27-25(26-28(34)32-22-7-5-4-6-21(22)31-26)29(35)33(18(3)30-27)14-19-8-9-23-24(13-19)37-15-36-23/h4-13H,14-15H2,1-3H3InChIKey
HQBNDBHZHVNBLC-UHFFFAOYSA-NSynonyms
380576-47-63(13benzodioxol5ylmethyl)11(35dimethylphenyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(benzo(d)(13)dioxol5ylmethyl)11(35dimethylphenyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
380576476
CC1=CC(=CC(=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)CC6=CC7=C(C=C6)OCO7)C
InChI=1SC29H23N5O3c1161017(2)1220(1116)342725(2628(34)3222754621(22)3126)29(35)33(18(3)3027)1419892324(1319)37153623h413H1415H213H3
MFCD02989476
ZINC000002261721
ZINC02261721
ZINC2261721
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