2-methyl-4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
2-methyl-4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
2-methyl-4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-2311 |
| Compound Name: | 2-methyl-4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 455.57 |
| Molecular Formula: | C18 H21 N3 O5 S3 |
| Smiles: | CC1CC(Nc2cc(ccc2S1)S(NCCc1ccc(cc1)S(N)(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3619 |
| logD: | 1.3611 |
| logSw: | -2.298 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 117.593 |
| InChI Key: | IBHVKNYMNLGMAY-GFCCVEGCSA-N |