4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 4-methoxybenzoate
Chemical Structure Depiction of
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 4-methoxybenzoate
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 4489-8422 |
| Compound Name: | 4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 4-methoxybenzoate |
| Molecular Weight: | 408.43 |
| Molecular Formula: | C21 H16 N2 O5 S |
| Smiles: | COc1ccc(cc1)C(=O)Oc1ccc(cc1)NC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3272 |
| logD: | 3.3172 |
| logSw: | -3.9341 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.766 |
| InChI Key: | QSKCGOOOUWBWOQ-UHFFFAOYSA-N |