4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-{3-[(1-methylpiperidin-4-yl)oxy]propyl}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-{3-[(1-methylpiperidin-4-yl)oxy]propyl}butanamide
4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-{3-[(1-methylpiperidin-4-yl)oxy]propyl}butanamide
Compound characteristics
| Compound ID: | N121-0834 |
| Compound Name: | 4-[(1R,3aS,10aR,10bS)-2-acetyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-{3-[(1-methylpiperidin-4-yl)oxy]propyl}butanamide |
| Molecular Weight: | 462.68 |
| Molecular Formula: | C26 H46 N4 O3 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(NCCCOC2CCN(C)CC2)=O)N(C1)C(C)=O |
| Stereo: | ABSOLUTE |
| logP: | -0.3349 |
| logD: | -2.9125 |
| logSw: | -0.6886 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.574 |
| InChI Key: | FVTRSMTXKXSSGK-IGGXFAESSA-N |