N-[2-(dimethylamino)ethyl]-4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}butanamide
Chemical Structure Depiction of
N-[2-(dimethylamino)ethyl]-4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}butanamide
N-[2-(dimethylamino)ethyl]-4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}butanamide
Compound characteristics
| Compound ID: | N121-0676 |
| Compound Name: | N-[2-(dimethylamino)ethyl]-4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}butanamide |
| Molecular Weight: | 427.63 |
| Molecular Formula: | C25 H41 N5 O |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(NCCN(C)C)=O)N(Cc2cccnc2)C1 |
| Stereo: | ABSOLUTE |
| logP: | 0.3175 |
| logD: | -1.228 |
| logSw: | -1.1786 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.139 |
| InChI Key: | MMXLGPPDGOVACD-VWBWNGLSSA-N |