1-benzyl-N-[(4-methylphenyl)methyl]-7-oxoazepane-2-carboxamide
Chemical Structure Depiction of
1-benzyl-N-[(4-methylphenyl)methyl]-7-oxoazepane-2-carboxamide
1-benzyl-N-[(4-methylphenyl)methyl]-7-oxoazepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0598 |
| Compound Name: | 1-benzyl-N-[(4-methylphenyl)methyl]-7-oxoazepane-2-carboxamide |
| Molecular Weight: | 350.46 |
| Molecular Formula: | C22 H26 N2 O2 |
| Smiles: | Cc1ccc(CNC(C2CCCCC(N2Cc2ccccc2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1145 |
| logD: | 3.1145 |
| logSw: | -3.1739 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.393 |
| InChI Key: | OHFHGPKPRQBOMK-FQEVSTJZSA-N |