3-[2-(methylsulfanyl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-[2-(methylsulfanyl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-[2-(methylsulfanyl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | 7380-0009 |
| Compound Name: | 3-[2-(methylsulfanyl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione |
| Molecular Weight: | 304.39 |
| Molecular Formula: | C14 H12 N2 O2 S2 |
| Smiles: | CSc1ccccc1NC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5594 |
| logD: | 2.551 |
| logSw: | -3.1721 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.147 |
| InChI Key: | CCAYRTVUHSPBJY-UHFFFAOYSA-N |