Vitas-M small molecule compound
8-(azepan-1-yl)-7-(3-bromobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK834931
SMILES Brc1cccc(c1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1
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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 C20H24BrN5O2 MW 446.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24BrN5O2/c1-23-17-16(18(27)24(2)20(23)28)26(13-14-8-7-9-15(21)12-14)19(22-17)25-10-5-3-4-6-11-25/h7-9,12H,3-6,10-11,13H2,1-2H3InChIKey
JHBMZWOUJZJJIL-UHFFFAOYSA-NSynonyms
324539-14-2324539142
8(AZEPAN1YL)7((3BROMOPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8(AZEPAN1YL)7(3BROMOBENZYL)13DIMETHYL1HPURINE26(3H7H)DIONE
8(azepan1yl)7(3bromobenzyl)13dimethyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCCC3)CC4=CC(=CC=C4)Br
InChI=1SC20H24BrN5O2c1231716(18(27)24(2)20(23)28)26(131487915(21)1214)19(2217)251053461125h7912H36101113H212H3
MFCD01532360
ZINC000002322662
ZINC02322662
ZINC2322662
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