1-methyl-7-oxo-N-{[4-(propan-2-yl)phenyl]methyl}azepane-2-carboxamide
Chemical Structure Depiction of
1-methyl-7-oxo-N-{[4-(propan-2-yl)phenyl]methyl}azepane-2-carboxamide
1-methyl-7-oxo-N-{[4-(propan-2-yl)phenyl]methyl}azepane-2-carboxamide
Compound characteristics
| Compound ID: | S513-0135 |
| Compound Name: | 1-methyl-7-oxo-N-{[4-(propan-2-yl)phenyl]methyl}azepane-2-carboxamide |
| Molecular Weight: | 302.42 |
| Molecular Formula: | C18 H26 N2 O2 |
| Smiles: | CC(C)c1ccc(CNC(C2CCCCC(N2C)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3681 |
| logD: | 2.3681 |
| logSw: | -2.7602 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.43 |
| InChI Key: | WNKSJKPTRXUGSU-INIZCTEOSA-N |