HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Cyclohexyl-2-methylsulfanylquinazolin-4-one

Identifiers & Physical Properties
| CAS No. | 83671-56-1 |
|---|---|
| Molecular formula | C15H18N2OS |
| Average molar mass | 274.4 g/mol |
| Monoisotopic mass | 274.11398438 g/mol |
| SMILES | CSc1nc2ccccc2c(=O)n1C1CCCCC1 |
| InChIKey | IWNOXYDFAMUXDF-UHFFFAOYSA-N |
| PubChem CID | 866369 |
| ChEMBL | CHEMBL1517465 |
| DTXSID | DTXSID801326465 |
Chemical & Physical Properties
| XLogP | 3.6 |
|---|---|
| Topological polar surface area | 58 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 19 |
| Formal charge | 0 |
| Complexity | 376 |
| Solubility | 1 [ug/mL] (The mean of the results at pH 7.4) |