4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}butanamide
Chemical Structure Depiction of
4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}butanamide
4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}butanamide
Compound characteristics
| Compound ID: | N121-0841 |
| Compound Name: | 4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-{2-[1-(propan-2-yl)piperidin-4-yl]ethyl}butanamide |
| Molecular Weight: | 460.7 |
| Molecular Formula: | C27 H48 N4 O2 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(NCCC2CCN(CC2)C(C)C)=O)N(C1)C(C)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.4866 |
| logD: | -1.091 |
| logSw: | -1.7866 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.03 |
| InChI Key: | DPBQYCHNJNVFGF-FCRYVSRXSA-N |