Vitas-M small molecule compound
8-bromo-1,3-dimethyl-7-(1-oxo-1-phenylhexan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK691419
SMILES CCCCC(n1c(Br)nc2c1c(=O)n(C)c(=O)n2C)C(=O)c1ccccc1
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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 C19H21BrN4O3 MW 433.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21BrN4O3/c1-4-5-11-13(15(25)12-9-7-6-8-10-12)24-14-16(21-18(24)20)22(2)19(27)23(3)17(14)26/h6-10,13H,4-5,11H2,1-3H3InChIKey
HRBSDSMVOCULSW-UHFFFAOYSA-NSynonyms
8bromo13dimethyl7(1oxo1phenylhexan2yl)37dihydro1Hpurine26dione
8bromo13dimethyl7(1oxo1phenylhexan2yl)purine26dione
CCCCC(C(=O)C1=CC=CC=C1)N2C3=C(N=C2Br)N(C(=O)N(C3=O)C)C
InChI=1SC19H21BrN4O3c1451113(15(25)1297681012)241416(2118(24)20)22(2)19(27)23(3)17(14)26h61013H4511H213H3
MFCD09064426
ZINC000012419634
ZINC000012419637
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