Vitas-M small molecule compound
11-[2-(3,4-dimethoxyphenyl)ethyl]-3-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK920243
SMILES COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1ncn(c2=O)CC1CCCO1
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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 C27H27N5O4 MW 485.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O4/c1-34-21-10-9-17(14-22(21)35-2)11-12-32-25-23(24-26(32)30-20-8-4-3-7-19(20)29-24)27(33)31(16-28-25)15-18-6-5-13-36-18/h3-4,7-10,14,16,18H,5-6,11-13,15H2,1-2H3InChIKey
DHEMURNQWBKMDM-UHFFFAOYSA-NSynonyms
799839-45-511(2(34dimethoxyphenyl)ethyl)3(tetrahydrofuran2ylmethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(34dimethoxyphenethyl)3((tetrahydrofuran2yl)methyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
799839455
COC1=C(C=C(C=C1)CCN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC6CCCO6)OC
InChI=1SC27H27N5O4c1342110917(1422(21)352)1112322523(2426(32)3020843719(20)2924)27(33)31(162825)151865133618h34710141618H56111315H212H3
MFCD03686023
ZINC000002247574
ZINC000002247575
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