| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID8072039 |
| InChI Key | ULNIIFVEDJYBOZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C19H19Cl1N4O2S1 |
| Molecular Weight | 402.09 |
| AlogP | 5.75 |
| Hydrogen Bond Acceptor | 7.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 67.15 |
| Heavy Atoms | 27.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 70198-17-3 |
| NORMAN SUSDAT | |
| PubChem | 112378 |
| ChemSpider | 100732.0 |