Vitas-M small molecule compound

8-{[benzyl(methyl)amino]methyl}-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione

Catalog ID
STK655527
SMILES CN(Cc1nc2c([nH]1)n(C)c(=O)n(c2=O)C)Cc1ccccc1

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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 C16H19N5O2 MW 313.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5O2/c1-19(9-11-7-5-4-6-8-11)10-12-17-13-14(18-12)20(2)16(23)21(3)15(13)22/h4-8H,9-10H2,1-3H3,(H,17,18)
InChIKey
LLVGFPWNUPYYTQ-UHFFFAOYSA-N
Synonyms
133231-17-1
133231171
13DIMETHYL8((METHYL(PHENYLMETHYL)AMINO)METHYL)7HPURINE26DIONE
13DIMETHYL8((METHYLBENZYLAMINO)METHYL)137TRIHYDROPURINE26DIONE
8((BENZYL(METHYL)AMINO)METHYL)13DIMETHYL1HPURINE26(3H7H)DIONE
8((benzyl(methyl)amino)methyl)13dimethyl39dihydro1Hpurine26dione
8((BENZYL(METHYL)AMINO)METHYL)13DIMETHYL7HPURINE26DIONE
8((BENZYL(METHYL)AMINO)METHYL)13DIMETHYL7HPURINE26QUINONE
8((BENZYLMETHYLAMINO)METHYL)13DIMETHYL37DIHYDROPURINE26DIONE
CN(Cc1(nH)c2c(n1)n(C)c(=O)n(c2=O)C)Cc1ccccc1
CN(Cc1nc2c((nH)1)n(C)c(=O)n(c2=O)C)Cc1ccccc1
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CN(C)CC3=CC=CC=C3
InChI=1SC16H19N5O2c119(9117546811)1012171314(1812)20(2)16(23)21(3)15(13)22h48H910H213H3(H1718)
MFCD18167384
ZINC000006529477
ZINC6529477

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Available files

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