Vitas-M small molecule compound

8-(dimethylamino)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK839949
SMILES Cc1cccc(c1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N(C)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 C16H19N5O2 MW 313.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5O2/c1-10-6-5-7-11(8-10)9-21-12-13(17-15(21)19(2)3)20(4)16(23)18-14(12)22/h5-8H,9H2,1-4H3,(H,18,22,23)
InChIKey
QGZFFVJZUONRJR-UHFFFAOYSA-N
Synonyms
332897-33-3
332897333
8(DIMETHYLAMINO)3METHYL7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
8(DIMETHYLAMINO)3METHYL7((3METHYLPHENYL)METHYL)37DIHYDRO1HPURINE26DIONE
8(DIMETHYLAMINO)3METHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8(DIMETHYLAMINO)3METHYL7(3METHYLBENZYL)1HPURINE26(3H7H)DIONE
8(dimethylamino)3methyl7(3methylbenzyl)37dihydro1Hpurine26dione
8DIMETHYLAMINO3METHYL7(3METHYLBENZYL)37DIHYDROPURINE26DIONE
CC1=CC(=CC=C1)CN2C3=C(N=C2N(C)C)N(C(=O)NC3=O)C
Cc1cccc(c1)Cn1c(nc2c1c(=O)(nH)c(=O)n2C)N(C)C
InChI=1SC16H19N5O2c11065711(810)9211213(1715(21)19(2)3)20(4)16(23)1814(12)22h58H9H214H3(H182223)
MFCD01186426
ZINC000000282243
ZINC00282243
ZINC282243

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Available files

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