1-benzyl-7-oxo-N-{[4-(trifluoromethoxy)phenyl]methyl}azepane-2-carboxamide
Chemical Structure Depiction of
1-benzyl-7-oxo-N-{[4-(trifluoromethoxy)phenyl]methyl}azepane-2-carboxamide
1-benzyl-7-oxo-N-{[4-(trifluoromethoxy)phenyl]methyl}azepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0604 |
| Compound Name: | 1-benzyl-7-oxo-N-{[4-(trifluoromethoxy)phenyl]methyl}azepane-2-carboxamide |
| Molecular Weight: | 420.43 |
| Molecular Formula: | C22 H23 F3 N2 O3 |
| Smiles: | C1CCC(N(Cc2ccccc2)C(C1)C(NCc1ccc(cc1)OC(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8823 |
| logD: | 3.8823 |
| logSw: | -4.0149 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.329 |
| InChI Key: | OMHGJHNDIGZVLA-IBGZPJMESA-N |