HuagongsheHuagongshe Chemistry Print Report · For research reference only
5-Chloro-1-desylpyrimidin-2-one

Identifiers & Physical Properties
| Molecular formula | C18H13ClN2O2 |
|---|---|
| Average molar mass | 324.8 g/mol |
| SMILES | O=C(c1ccccc1)C(c1ccccc1)n1cc(Cl)cnc1=O |
| InChIKey | ZJXSNAAUFVMPEL-UHFFFAOYSA-N |
| PubChem CID | 12795560 |
Chemical & Physical Properties
| XLogP | 3.4 |
|---|---|
| Topological polar surface area | 49.7 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 4 |
| Heavy atoms | 23 |
| Formal charge | 0 |
| Complexity | 517 |