AC1MQDWJ
1-[(4-bromophenyl)methyl]-8-(4-chloro-3,5-dimethylphenoxy)-3,7-dimethylpurine-2,6-dione
Also Known As: Oprea1_741088|1-[(4-bromophenyl)methyl]-8-(4-chloro-3,5-dimethylphenoxy)-3,7-dimethylpurine-2,6-dione|1-(4-bromobenzyl)-8-(4-chloro-3,5-dimethylphenoxy)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione|1-(4-bromobenzyl)-8-(4-chloro-3,5-dimethylphenoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione|1-[(4-bromophenyl)methyl]-8-(4-chloro-3,5-dimethyl-phenoxy)-3,7-dimethyl-purine-2,6-dione
CAS: 369605-88-9
| Molecular Formula | C22H20BrClN4O3 |
|---|---|
| Molecular Weight | 502.04074 g/mol |
| LogP | 4.30704 |
| Topological Polar Surface Area | 71.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 502.04074 |
| Monoisotopic Mass | 502.04074 |
| Heavy Atoms | 31 |
| Complexity | 1411.6415 |
Chemical Identifiers
| CAS Number | 369605-88-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1Cl)C)OC2=NC3=C(N2C)C(=O)N(C(=O)N3C)CC4=CC=C(C=C4)Br |
Product Overview
AC1MQDWJ (CAS 369605-88-9), with molecular formula C22H20BrClN4O3 and molecular weight 502.04074 g/mol. IUPAC: 1-[(4-bromophenyl)methyl]-8-(4-chloro-3,5-dimethylphenoxy)-3,7-dimethylpurine-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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