AC1MXNRK
7-[(3-bromophenyl)methyl]-1,3-dimethyl-8-(3-morpholin-4-ylpropylamino)purine-2,6-dione
Also Known As: 7-[(3-bromophenyl)methyl]-1,3-dimethyl-8-(3-morpholin-4-ylpropylamino)purine-2,6-dione|7-(3-bromobenzyl)-1,3-dimethyl-8-((3-morpholinopropyl)amino)-1H-purine-2,6(3H,7H)-dione|7-(3-bromobenzyl)-1,3-dimethyl-8-{[3-(morpholin-4-yl)propyl]amino}-3,7-dihydro-1H-purine-2,6-dione
CAS: 587002-67-3
| Molecular Formula | C21H27BrN6O3 |
|---|---|
| Molecular Weight | 490.1328 g/mol |
| LogP | 1.3787 |
| Topological Polar Surface Area | 86.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 490.1328 |
| Monoisotopic Mass | 490.1328 |
| Heavy Atoms | 31 |
| Complexity | 1192.2688 |
Chemical Identifiers
| CAS Number | 587002-67-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCCN3CCOCC3)CC4=CC(=CC=C4)Br |
Product Overview
AC1MXNRK (CAS 587002-67-3), with molecular formula C21H27BrN6O3 and molecular weight 490.1328 g/mol. IUPAC: 7-[(3-bromophenyl)methyl]-1,3-dimethyl-8-(3-morpholin-4-ylpropylamino)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.
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