Vitas-M small molecule compound

8-[benzyl(methyl)amino]-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK840623
SMILES Cc1cccc(c1)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N(Cc1ccccc1)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 C23H25N5O2 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O2/c1-16-9-8-12-18(13-16)15-28-19-20(26(3)23(30)27(4)21(19)29)24-22(28)25(2)14-17-10-6-5-7-11-17/h5-13H,14-15H2,1-4H3
InChIKey
SKNAJEYYWIUKDG-UHFFFAOYSA-N
Synonyms
377061-04-6
13DIMETHYL7((3METHYLPHENYL)METHYL)8(METHYLBENZYLAMINO)137TRIHYDROPURINE26DIONE
377061046
8(BENZYL(METHYL)AMINO)13DIMETHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8(BENZYL(METHYL)AMINO)13DIMETHYL7(3METHYLBENZYL)1HPURINE26(3H7H)DIONE
8(benzyl(methyl)amino)13dimethyl7(3methylbenzyl)37dihydro1Hpurine26dione
CC1=CC(=CC=C1)CN2C3=C(N=C2N(C)CC4=CC=CC=C4)N(C(=O)N(C3=O)C)C
InChI=1SC23H25N5O2c116981218(1316)15281920(26(3)23(30)27(4)21(19)29)2422(28)25(2)1417106571117h513H1415H214H3
MFCD02983430
ZINC000000629269
ZINC00629269
ZINC629269

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.