Vitas-M small molecule compound
11-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-heptyl-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990456
SMILES CCCCCCCn1c(C)nc2c(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 C28H29N5O3 MW 483.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O3/c1-3-4-5-6-9-14-32-18(2)29-26-24(28(32)34)25-27(31-21-11-8-7-10-20(21)30-25)33(26)19-12-13-22-23(17-19)36-16-15-35-22/h7-8,10-13,17H,3-6,9,14-16H2,1-2H3InChIKey
SVCDVLQCICGDCI-UHFFFAOYSA-NSynonyms
848671-22-711(23dihydro14benzodioxin6yl)3heptyl2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(23dihydrobenzo(b)(14)dioxin6yl)3heptyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
848671227
CCCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC6=C(C=C5)OCCO6)C
InChI=1SC28H29N5O3c134569143218(2)292624(28(32)34)2527(312111871020(21)3025)33(26)1912132223(1719)3616153522h78101317H3691416H212H3
MFCD04190576
ZINC000002426048
ZINC2426048
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