6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}pyridine-3-carboxamide
Chemical Structure Depiction of
6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}pyridine-3-carboxamide
6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | N115-0034 |
| Compound Name: | 6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]-N-{3-[(propan-2-yl)oxy]propyl}pyridine-3-carboxamide |
| Molecular Weight: | 414.55 |
| Molecular Formula: | C23 H34 N4 O3 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)c1ccc(cn1)C(NCCCOC(C)C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.0505 |
| logD: | 2.0505 |
| logSw: | -2.5392 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.253 |
| InChI Key: | ZWJJGNSYGQEZSC-MISYRCLQSA-N |