Vitas-M small molecule compound
11-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-heptyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL233382
SMILES CCCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc2c(c1)OCCO2
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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 C27H27N5O3 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O3/c1-2-3-4-5-8-13-31-17-28-25-23(27(31)33)24-26(30-20-10-7-6-9-19(20)29-24)32(25)18-11-12-21-22(16-18)35-15-14-34-21/h6-7,9-12,16-17H,2-5,8,13-15H2,1H3InChIKey
FKGZLJSEMGBBFX-UHFFFAOYSA-NSynonyms
844456-69-511(23dihydro14benzodioxin6yl)3heptyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(23dihydrobenzo(b)(14)dioxin6yl)3heptyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
844456695
CCCCCCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC6=C(C=C5)OCCO6
InChI=1SC27H27N5O3c123458133117282523(27(31)33)2426(30201076919(20)2924)32(25)1811122122(1618)3515143421h679121617H2581315H21H3
MFCD04156806
ZINC000002401973
ZINC2401973
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