AC1NQ1QX
1-[(4-bromophenyl)methyl]-3,7-dimethyl-8-(3-propan-2-yloxypropylamino)purine-2,6-dione
Also Known As: 1-[(4-bromophenyl)methyl]-3,7-dimethyl-8-(3-propan-2-yloxypropylamino)purine-2,6-dione|1-(4-bromobenzyl)-8-((3-isopropoxypropyl)amino)-3,7-dimethyl-1H-purine-2,6(3H,7H)-dione|1-(4-bromobenzyl)-3,7-dimethyl-8-{[3-(propan-2-yloxy)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione
CAS: 577985-57-0
| Molecular Formula | C20H26BrN5O3 |
|---|---|
| Molecular Weight | 463.1219 g/mol |
| LogP | 2.4715 |
| Topological Polar Surface Area | 83.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 463.1219 |
| Monoisotopic Mass | 463.1219 |
| Heavy Atoms | 29 |
| Complexity | 1112.3228 |
Chemical Identifiers
| CAS Number | 577985-57-0 |
|---|---|
| SMILES | CC(C)OCCCNC1=NC2=C(N1C)C(=O)N(C(=O)N2C)CC3=CC=C(C=C3)Br |
Product Overview
AC1NQ1QX (CAS 577985-57-0), with molecular formula C20H26BrN5O3 and molecular weight 463.1219 g/mol. IUPAC: 1-[(4-bromophenyl)methyl]-3,7-dimethyl-8-(3-propan-2-yloxypropylamino)purine-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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