2-methyl-4-oxo-N-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
2-methyl-4-oxo-N-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
2-methyl-4-oxo-N-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-2287 |
| Compound Name: | 2-methyl-4-oxo-N-(4-sulfamoylphenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C16 H17 N3 O5 S3 |
| Smiles: | CC1CC(Nc2cc(ccc2S1)S(Nc1ccc(cc1)S(N)(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2679 |
| logD: | 0.0364 |
| logSw: | -2.3115 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 116.643 |
| InChI Key: | KTVBILAMIOLFTR-SNVBAGLBSA-N |