3-anilino-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-anilino-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-anilino-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | 8001-2174 |
| Compound Name: | 3-anilino-1H-1lambda~6~,2-benzothiazole-1,1-dione |
| Molecular Weight: | 258.3 |
| Molecular Formula: | C13 H10 N2 O2 S |
| Smiles: | c1ccc(cc1)NC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0536 |
| logD: | 2.0492 |
| logSw: | -2.9792 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.844 |
| InChI Key: | PMSHCTAHVFWNET-UHFFFAOYSA-N |