3-[4-(propan-2-yl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione
Chemical Structure Depiction of
3-[4-(propan-2-yl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione
3-[4-(propan-2-yl)anilino]-1H-1lambda~6~,2-benzothiazole-1,1-dione
Compound characteristics
| Compound ID: | 6291-0884 |
| Compound Name: | 3-[4-(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)c1ccc(cc1)NC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5836 |
| logD: | 3.5777 |
| logSw: | -3.8622 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.844 |
| InChI Key: | CPCGKNMZKDZDNF-UHFFFAOYSA-N |