| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Y4SEF4NTW3 |
| EPA CompTox | DTXSID4059671 |
| InChI Key | HBTAOSGHCXUEKI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H9Cl1N2O4S1 |
| Molecular Weight | 264.0 |
| AlogP | 1.5 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 80.52 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 137-47-3 |
| NORMAN SUSDAT | |
| FDA SRS | Y4SEF4NTW3 |
| PubChem | 67300 |
| ChemSpider | 60632.0 |