Vitas-M small molecule compound
8-[(dibenzylamino)methyl]-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL003713
SMILES Cc1ccc(cc1)Cn1c(CN(Cc2ccccc2)Cc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C
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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 C30H31N5O2 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N5O2/c1-22-14-16-25(17-15-22)20-35-26(31-28-27(35)29(36)33(3)30(37)32(28)2)21-34(18-23-10-6-4-7-11-23)19-24-12-8-5-9-13-24/h4-17H,18-21H2,1-3H3InChIKey
XQRQNGHGUASPJC-UHFFFAOYSA-NSynonyms
577767-00-1577767001
8((DIBENZYLAMINO)METHYL)13DIMETHYL7((4METHYLPHENYL)METHYL)PURINE26DIONE
8((dibenzylamino)methyl)13dimethyl7(4methylbenzyl)1Hpurine26(3H7H)dione
8((dibenzylamino)methyl)13dimethyl7(4methylbenzyl)37dihydro1Hpurine26dione
CC1=CC=C(C=C1)CN2C(=NC3=C2C(=O)N(C(=O)N3C)C)CN(CC4=CC=CC=C4)CC5=CC=CC=C5
InChI=1SC30H31N5O2c122141625(171522)203526(312827(35)29(36)33(3)30(37)32(28)2)2134(1823106471123)1924128591324h417H1821H213H3
MFCD04019073
ZINC000057010879
ZINC57010879
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