Stk237441
3-benzyl-7-methylpurine-2,6-dione
Also Known As: 3-Benzyl-7-methylxanthine|3-benzyl-7-methylpurine-2,6-dione|3-benzyl-7-methyl-3,7-dihydro-1H-purine-2,6-dione|3-benzyl-7-methyl-purine-2,6-dione|1H-Purine-2,6-dione, 3,7-dihydro-7-methyl-3-(phenylmethyl)-|AK-968/40809308|3-benzyl-7-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
CAS: 64995-73-9
| Molecular Formula | C13H12N4O2 |
|---|---|
| Molecular Weight | 256.09604 g/mol |
| LogP | 0.4716 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.09604 |
| Monoisotopic Mass | 256.09604 |
| Heavy Atoms | 19 |
| Complexity | 842.446 |
Chemical Identifiers
| CAS Number | 64995-73-9 |
|---|---|
| SMILES | CN1C=NC2=C1C(=O)NC(=O)N2CC3=CC=CC=C3 |
Product Overview
Stk237441 (CAS 64995-73-9), with molecular formula C13H12N4O2 and molecular weight 256.09604 g/mol. IUPAC: 3-benzyl-7-methylpurine-2,6-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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