2-(2-methylpropoxy)-4-oxo-N-[3-(1H-pyrazol-1-yl)propyl]-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide
Chemical Structure Depiction of
2-(2-methylpropoxy)-4-oxo-N-[3-(1H-pyrazol-1-yl)propyl]-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide
2-(2-methylpropoxy)-4-oxo-N-[3-(1H-pyrazol-1-yl)propyl]-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide
Compound characteristics
| Compound ID: | P734-2708 |
| Compound Name: | 2-(2-methylpropoxy)-4-oxo-N-[3-(1H-pyrazol-1-yl)propyl]-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxamide |
| Molecular Weight: | 386.49 |
| Molecular Formula: | C21 H30 N4 O3 |
| Smiles: | CC(C)COC1=CC(N2CCCCCC2=C1C(NCCCn1cccn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8667 |
| logD: | 1.8636 |
| logSw: | -2.0571 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.548 |
| InChI Key: | XYHOTTGPOUPMAJ-UHFFFAOYSA-N |