4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3,4,5-trimethoxybenzoate
4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | 5251-2400 |
| Compound Name: | 4-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]phenyl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 468.48 |
| Molecular Formula: | C23 H20 N2 O7 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(=O)Oc1ccc(cc1)NC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7762 |
| logD: | 2.7662 |
| logSw: | -3.8096 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.2 |
| InChI Key: | VAVNCFGBCMEOII-UHFFFAOYSA-N |