Compound C12H18N4O2
1,8-dimethyl-3-(2-methylbutyl)-7H-purine-2,6-dione
| Molecular Formula | C12H18N4O2 |
|---|---|
| Molecular Weight | 250.3 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 69.3 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.14297 |
| Heavy Atoms | 18 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 66172-75-6 |
|---|---|
| SMILES | CCC(C)CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C |
| InChIKey | MTBUJUHRXVGLEF-UHFFFAOYSA-N |
📖 Product Overview
Compound C12H18N4O2 (CAS: 66172-75-6) is a chemical compound with molecular formula C12H18N4O2 and molecular weight 250.3 g/mol. Its IUPAC systematic name is 1,8-dimethyl-3-(2-methylbutyl)-7H-purine-2,6-dione.
MTBUJUHRXVGLEF-UHFFFAOYSA-N.
SMILES: CCC(C)CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C.
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