N-ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-2-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-2-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]acetamide
N-ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-2-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | N108-0212 |
| Compound Name: | N-ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-2-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]acetamide |
| Molecular Weight: | 387.52 |
| Molecular Formula: | C21 H33 N5 O2 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(CC(N(CC)Cc1cnn(CC)c1)=O)C2)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.2277 |
| logD: | 0.1556 |
| logSw: | -0.5104 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.386 |
| InChI Key: | AMABYAVIPAWYCG-BHIYHBOVSA-N |