2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 3,4,5-trimethoxybenzoate
2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | 2461-0008 |
| Compound Name: | 2-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]ethyl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 420.44 |
| Molecular Formula: | C19 H20 N2 O7 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(=O)OCCNC1c2ccccc2S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9536 |
| logD: | 1.9536 |
| logSw: | -2.9501 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.034 |
| InChI Key: | UILHDPOTIMLZBJ-UHFFFAOYSA-N |