Vitas-M small molecule compound
8-[(1,3-benzodioxol-5-ylmethyl)amino]-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK804412
SMILES Cc1cccc(c1)Cn1c(NCc2ccc3c(c2)OCO3)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 C23H23N5O4 MW 433.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O4/c1-14-5-4-6-16(9-14)12-28-19-20(26(2)23(30)27(3)21(19)29)25-22(28)24-11-15-7-8-17-18(10-15)32-13-31-17/h4-10H,11-13H2,1-3H3,(H,24,25)InChIKey
RSUBGPJHWAUQCY-UHFFFAOYSA-NSynonyms
359905-89-8359905898
8((13benzodioxol5ylmethyl)amino)13dimethyl7(3methylbenzyl)37dihydro1Hpurine26dione
8((benzo(d)(13)dioxol5ylmethyl)amino)13dimethyl7(3methylbenzyl)1Hpurine26(3H7H)dione
8(13BENZODIOXOL5YLMETHYLAMINO)13DIMETHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2NCC4=CC5=C(C=C4)OCO5)N(C(=O)N(C3=O)C)C
InChI=1SC23H23N5O4c11454616(914)12281920(26(2)23(30)27(3)21(19)29)2522(28)241115781718(1015)32133117h410H1113H213H3(H2425)
MFCD04190237
ZINC000001070434
ZINC01070434
ZINC1070434
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