HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-chlorophenyl)acetamide
2-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-chlorophenyl)acetamide
Identifiers & Physical Properties
| CAS No. | 386765-59-9 |
|---|---|
| Molecular formula | C15H11ClN2OS2 |
| Average molar mass | 334.8 g/mol |
| SMILES | O=C(CSc1nc2ccccc2s1)Nc1cccc(Cl)c1 |
| InChIKey | DQZMZTAAYDATQV-UHFFFAOYSA-N |
Chemical & Physical Properties
| XLogP | 4.8 |
|---|---|
| Topological polar surface area | 95.5 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 4 |
| Heavy atoms | 21 |
| Formal charge | 0 |
| Complexity | 372 |