1-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl]-N-(3-phenylpropyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl]-N-(3-phenylpropyl)piperidine-4-carboxamide
1-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl]-N-(3-phenylpropyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | N117-0028 |
| Compound Name: | 1-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbonyl]-N-(3-phenylpropyl)piperidine-4-carboxamide |
| Molecular Weight: | 466.62 |
| Molecular Formula: | C27 H38 N4 O3 |
| Smiles: | [H][C@@]12CCCC(N2CC2C[C@@H]1CN(C2)C(N1CCC(CC1)C(NCCCc1ccccc1)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8566 |
| logD: | 2.8566 |
| logSw: | -3.2629 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.181 |
| InChI Key: | LWHVWLWBSJZVJZ-QPTUXGOLSA-N |