Vitas-M small molecule compound

3-(2-chlorobenzyl)-11-(2,5-dimethoxyphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STL338586
SMILES COc1ccc(c(c1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)Cc1ccccc1Cl)OC

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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 C28H22ClN5O3 MW 511.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN5O3/c1-16-30-26-24(28(35)33(16)15-17-8-4-5-9-19(17)29)25-27(32-21-11-7-6-10-20(21)31-25)34(26)22-14-18(36-2)12-13-23(22)37-3/h4-14H,15H2,1-3H3
InChIKey
XXYPPJLCVGOALS-UHFFFAOYSA-N
Synonyms
840459-33-8
3(2chlorobenzyl)11(25dimethoxyphenyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(2chlorobenzyl)11(25dimethoxyphenyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
840459338
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=C(C=CC(=C5)OC)OC)C(=O)N1CC6=CC=CC=C6Cl
InChI=1SC28H22ClN5O3c116302624(28(35)33(16)1517845919(17)29)2527(322111761020(21)3125)34(26)221418(362)121323(22)373h414H15H213H3
MFCD03694824
ZINC000002257586
ZINC02257586
ZINC2257586

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Available files

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