N-(2,4-dimethylphenyl)-6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridine-3-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridine-3-carboxamide
N-(2,4-dimethylphenyl)-6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | N115-0063 |
| Compound Name: | N-(2,4-dimethylphenyl)-6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridine-3-carboxamide |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C25 H30 N4 O2 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)c1ccc(cn1)C(Nc1ccc(C)cc1C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.8992 |
| logD: | 3.8986 |
| logSw: | -3.8382 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.919 |
| InChI Key: | NPUVUGJSJVXLDC-CZTZKLFOSA-N |