N-[(4-fluorophenyl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
N-[(4-fluorophenyl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide
Compound characteristics
| Compound ID: | G017-1162 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-N~2~-(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)valinamide |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C22 H26 F N3 O4 S |
| Smiles: | CC(C)C(C(NCc1ccc(cc1)F)=O)NS(c1ccc2c(CCCC(N2)=O)c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.22 |
| logD: | 2.2195 |
| logSw: | -2.9324 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.399 |
| InChI Key: | UCZNQABRTKZCKN-NRFANRHFSA-N |