4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl benzoate
Chemical Structure Depiction of
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl benzoate
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl benzoate
Compound characteristics
| Compound ID: | 8008-4681 |
| Compound Name: | 4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl benzoate |
| Molecular Weight: | 378.4 |
| Molecular Formula: | C20 H14 N2 O4 S |
| Smiles: | c1ccc(cc1)C(=O)Oc1ccc(cc1)NC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2398 |
| logD: | 3.2298 |
| logSw: | -3.9288 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.222 |
| InChI Key: | DLKYQRHBHSAEFA-UHFFFAOYSA-N |