methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate
Chemical Structure Depiction of
methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate
methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate
Compound characteristics
| Compound ID: | G786-1540 |
| Compound Name: | methyl 4-[(6-sulfamoyl-1,3-benzothiazol-2-yl)carbamoyl]benzoate |
| Molecular Weight: | 391.42 |
| Molecular Formula: | C16 H13 N3 O5 S2 |
| Smiles: | COC(c1ccc(cc1)C(Nc1nc2ccc(cc2s1)S(N)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5897 |
| logD: | 2.5826 |
| logSw: | -3.4032 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.868 |
| InChI Key: | QMEUCPKZAHZDCP-UHFFFAOYSA-N |