1-benzyl-N-[(3-fluorophenyl)methyl]-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
1-benzyl-N-[(3-fluorophenyl)methyl]-7-oxoazepane-2-carboxamide
1-benzyl-N-[(3-fluorophenyl)methyl]-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0595 |
| Compound Name: | 1-benzyl-N-[(3-fluorophenyl)methyl]-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 354.42 |
| Molecular Formula: | C21 H23 F N2 O2 |
| Smiles: | C1CCC(N(Cc2ccccc2)C(C1)C(NCc1cccc(c1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8552 |
| logD: | 2.8552 |
| logSw: | -3.2406 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.393 |
| InChI Key: | XBWNUMRUURXTIO-IBGZPJMESA-N |