methyl 3-[(4-acetamidophenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(4-acetamidophenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
methyl 3-[(4-acetamidophenyl)sulfamoyl]-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0648 |
| Compound Name: | methyl 3-[(4-acetamidophenyl)sulfamoyl]-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 404.46 |
| Molecular Formula: | C18 H16 N2 O5 S2 |
| Smiles: | CC(Nc1ccc(cc1)NS(c1c2ccccc2sc1C(=O)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9848 |
| logD: | 2.9496 |
| logSw: | -3.4803 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.071 |
| InChI Key: | XYDUJBUIBDTYMB-UHFFFAOYSA-N |