5-acetyl-N-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
5-acetyl-N-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
5-acetyl-N-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G269-0084 |
| Compound Name: | 5-acetyl-N-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C17 H19 N3 O5 S3 |
| Smiles: | CC(N1CCCSc2ccc(cc12)S(Nc1ccc(cc1)S(N)(=O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.583 |
| logD: | 0.3515 |
| logSw: | -2.5636 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.874 |
| InChI Key: | WFYHZVOUDHCRTR-UHFFFAOYSA-N |