N,N-diethyl-4-[7-fluoro-5-(4-fluorophenyl)-2-oxo-1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carbonyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-4-[7-fluoro-5-(4-fluorophenyl)-2-oxo-1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carbonyl]benzene-1-sulfonamide
N,N-diethyl-4-[7-fluoro-5-(4-fluorophenyl)-2-oxo-1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carbonyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | C076-0487 |
| Compound Name: | N,N-diethyl-4-[7-fluoro-5-(4-fluorophenyl)-2-oxo-1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carbonyl]benzene-1-sulfonamide |
| Molecular Weight: | 513.56 |
| Molecular Formula: | C26 H25 F2 N3 O4 S |
| Smiles: | CCN(CC)S(c1ccc(cc1)C(N1CC(Nc2ccc(cc2C1c1ccc(cc1)F)F)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9353 |
| logD: | 3.9353 |
| logSw: | -3.9825 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.122 |
| InChI Key: | QBPARHVTVUPFJP-VWLOTQADSA-N |