(4-methylphenyl)methyl 2-ethoxy-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxylate
Chemical Structure Depiction of
(4-methylphenyl)methyl 2-ethoxy-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxylate
(4-methylphenyl)methyl 2-ethoxy-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxylate
Compound characteristics
| Compound ID: | P733-0291 |
| Compound Name: | (4-methylphenyl)methyl 2-ethoxy-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxylate |
| Molecular Weight: | 355.43 |
| Molecular Formula: | C21 H25 N O4 |
| Smiles: | CCOC1=CC(N2CCCCCC2=C1C(=O)OCc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8112 |
| logD: | 3.8112 |
| logSw: | -3.9247 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.003 |
| InChI Key: | XTNCUWILSJLHIR-UHFFFAOYSA-N |