N-[(3-methylphenyl)methyl]-2-(2-methylpropoxy)-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide
Chemical Structure Depiction of
N-[(3-methylphenyl)methyl]-2-(2-methylpropoxy)-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide
N-[(3-methylphenyl)methyl]-2-(2-methylpropoxy)-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide
Compound characteristics
| Compound ID: | P734-2665 |
| Compound Name: | N-[(3-methylphenyl)methyl]-2-(2-methylpropoxy)-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C23 H30 N2 O3 |
| Smiles: | CC(C)COC1=CC(N2CCCCCC2=C1C(NCc1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1998 |
| logD: | 4.0169 |
| logSw: | -4.2391 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.934 |
| InChI Key: | JKXYSVIYGHUHHU-UHFFFAOYSA-N |