methyl 3-{[(4-methylphenyl)methyl]sulfamoyl}-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{[(4-methylphenyl)methyl]sulfamoyl}-1-benzothiophene-2-carboxylate
methyl 3-{[(4-methylphenyl)methyl]sulfamoyl}-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0485 |
| Compound Name: | methyl 3-{[(4-methylphenyl)methyl]sulfamoyl}-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 375.46 |
| Molecular Formula: | C18 H17 N O4 S2 |
| Smiles: | Cc1ccc(CNS(c2c3ccccc3sc2C(=O)OC)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9215 |
| logD: | 3.9199 |
| logSw: | -3.9765 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.917 |
| InChI Key: | IWTLJYKJGBVTEG-UHFFFAOYSA-N |