N-[(3,4-dimethylphenyl)methyl]-2-ethoxy-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide
Chemical Structure Depiction of
N-[(3,4-dimethylphenyl)methyl]-2-ethoxy-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide
N-[(3,4-dimethylphenyl)methyl]-2-ethoxy-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide
Compound characteristics
| Compound ID: | P734-2569 |
| Compound Name: | N-[(3,4-dimethylphenyl)methyl]-2-ethoxy-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide |
| Molecular Weight: | 368.48 |
| Molecular Formula: | C22 H28 N2 O3 |
| Smiles: | CCOC1=CC(N2CCCCCC2=C1C(NCc1ccc(C)c(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6467 |
| logD: | 3.4638 |
| logSw: | -3.7061 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.558 |
| InChI Key: | BONKCCQKHPXUNS-UHFFFAOYSA-N |