Vitas-M small molecule compound

1,3-dimethyl-7-[2-(4-methylphenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK215972
SMILES Cc1ccc(cc1)C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C

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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 C16H16N4O3 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O3/c1-10-4-6-11(7-5-10)12(21)8-20-9-17-14-13(20)15(22)19(3)16(23)18(14)2/h4-7,9H,8H2,1-3H3
InChIKey
WQXMCPGBMYHDJA-UHFFFAOYSA-N
Synonyms
540773-63-5
13DIMETHYL7(2(4METHYLPHENYL)2OXOETHYL)37DIHYDRO1HPURINE26DIONE
13DIMETHYL7(2(4METHYLPHENYL)2OXOETHYL)PURINE26DIONE
13DIMETHYL7(2OXO2PTOLYLETHYL)37DIHYDROPURINE26DIONE
540773635
CC1=CC=C(C=C1)C(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C
InChI=1SC16H16N4O3c1104611(7510)12(21)8209171413(20)15(22)19(3)16(23)18(14)2h479H8H213H3
MFCD07360627
ZINC000004386121
ZINC04386121
ZINC4386121

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Available files

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