3-[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
3-[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | Y044-0084 |
| Compound Name: | 3-[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide |
| Molecular Weight: | 447.57 |
| Molecular Formula: | C21 H25 N3 O4 S2 |
| Smiles: | C1Cc2ccccc2NC(C1SCCC(NCCc1ccc(cc1)S(N)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1334 |
| logD: | 1.1327 |
| logSw: | -2.0384 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 100.092 |
| InChI Key: | RRPNCACVLBBXFM-IBGZPJMESA-N |