AC1N7PN0
8-[2-(1,3-dimethyl-2-oxo-6-sulfanylidene-7H-purin-8-yl)ethyl]-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one
Also Known As: 8-[2-(1,3-dimethyl-2-oxo-6-sulfanylidene-7H-purin-8-yl)ethyl|8-[2-(1,3-dimethyl-2-oxo-6-sulfanylidene-7H-purin-8-yl)ethyl]-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one|8,8'-(Ethane-1,2-diyl)bis(1,3-dimethyl-6-sulfanylidene-1,3,6,7-tetrahydro-2H-purin-2-one)
CAS: 6466-33-7
| Molecular Formula | C16H18N8O2S2 |
|---|---|
| Molecular Weight | 418.09943 g/mol |
| LogP | 0.75778 |
| Topological Polar Surface Area | 111.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.09943 |
| Monoisotopic Mass | 418.09943 |
| Heavy Atoms | 28 |
| Complexity | 1380.1086 |
Chemical Identifiers
| CAS Number | 6466-33-7 |
|---|---|
| SMILES | CN1C2=C(C(=S)N(C1=O)C)NC(=N2)CCC3=NC4=C(N3)C(=S)N(C(=O)N4C)C |
Product Overview
AC1N7PN0 (CAS 6466-33-7), with molecular formula C16H18N8O2S2 and molecular weight 418.09943 g/mol. IUPAC: 8-[2-(1,3-dimethyl-2-oxo-6-sulfanylidene-7H-purin-8-yl)ethyl]-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one.
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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