AC1MSMG1
8-[(2-chlorophenyl)methylsulfanyl]-1,3-dimethyl-7-(3-methylbutyl)purine-2,6-dione
Also Known As: 8-((2-chlorobenzyl)thio)-7-isopentyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione|8-[(2-chlorophenyl)methylsulfanyl]-1,3-dimethyl-7-(3-methylbutyl)purine-2,6-dione|8-[(2-chlorobenzyl)sulfanyl]-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
CAS: 489396-52-3
| Molecular Formula | C19H23ClN4O2S |
|---|---|
| Molecular Weight | 406.12302 g/mol |
| LogP | 3.4255 |
| Topological Polar Surface Area | 61.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.12302 |
| Monoisotopic Mass | 406.12302 |
| Heavy Atoms | 27 |
| Complexity | 1097.5083 |
Chemical Identifiers
| CAS Number | 489396-52-3 |
|---|---|
| SMILES | CC(C)CCN1C2=C(N=C1SCC3=CC=CC=C3Cl)N(C(=O)N(C2=O)C)C |
Product Overview
AC1MSMG1 (CAS 489396-52-3), with molecular formula C19H23ClN4O2S and molecular weight 406.12302 g/mol. IUPAC: 8-[(2-chlorophenyl)methylsulfanyl]-1,3-dimethyl-7-(3-methylbutyl)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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