dimethyl 5-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | D257-0765 |
| Compound Name: | dimethyl 5-[(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 374.37 |
| Molecular Formula: | C17 H14 N2 O6 S |
| Smiles: | COC(c1cc(cc(c1)NC1c2ccccc2S(N=1)(=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7342 |
| logD: | 2.676 |
| logSw: | -3.6521 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.192 |
| InChI Key: | BVJKYODLBZNUED-UHFFFAOYSA-N |