3-[2-(propan-2-yl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-[2-(propan-2-yl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-[2-(propan-2-yl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | 8006-6511 |
| Compound Name: | 3-[2-(propan-2-yl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione |
| Molecular Weight: | 300.38 |
| Molecular Formula: | C16 H16 N2 O2 S |
| Smiles: | CC(C)c1ccccc1NC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1115 |
| logD: | 3.1106 |
| logSw: | -3.6327 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.147 |
| InChI Key: | IRBVEFKJIORZMW-UHFFFAOYSA-N |