3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)-N-(4-sulfamoylphenyl)propanamide
Chemical Structure Depiction of
3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)-N-(4-sulfamoylphenyl)propanamide
3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)-N-(4-sulfamoylphenyl)propanamide
Compound characteristics
| Compound ID: | L705-2435 |
| Compound Name: | 3-(3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonyl)-N-(4-sulfamoylphenyl)propanamide |
| Molecular Weight: | 483.58 |
| Molecular Formula: | C19 H21 N3 O6 S3 |
| Smiles: | CC1CSc2ccc(cc2NC1=O)S(CCC(Nc1ccc(cc1)S(N)(=O)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7999 |
| logD: | 0.7948 |
| logSw: | -2.1232 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 127.964 |
| InChI Key: | LYNQBDXMICOZRR-GFCCVEGCSA-N |