dimethyl 5-[(1,2,3-benzothiadiazol-5-yl)carbamamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(1,2,3-benzothiadiazol-5-yl)carbamamido]benzene-1,3-dicarboxylate
dimethyl 5-[(1,2,3-benzothiadiazol-5-yl)carbamamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | D003-1095 |
| Compound Name: | dimethyl 5-[(1,2,3-benzothiadiazol-5-yl)carbamamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 386.38 |
| Molecular Formula: | C17 H14 N4 O5 S |
| Smiles: | COC(c1cc(cc(c1)NC(Nc1ccc2c(c1)nns2)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1552 |
| logD: | 4.1551 |
| logSw: | -4.3994 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.471 |
| InChI Key: | OJDCIZSXESJWEX-UHFFFAOYSA-N |