N-[3-(morpholin-4-yl)propyl]-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-[3-(morpholin-4-yl)propyl]-6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridine-3-carboxamide
N-[3-(morpholin-4-yl)propyl]-6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | N115-0003 |
| Compound Name: | N-[3-(morpholin-4-yl)propyl]-6-[(11aR)-8-oxooctahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]pyridine-3-carboxamide |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C24 H35 N5 O3 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)c1ccc(cn1)C(NCCCN1CCOCC1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.0797 |
| logD: | 0.6915 |
| logSw: | -1.8469 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.671 |
| InChI Key: | RNBUTRBSYQZNBM-HMXCVIKNSA-N |