N-methyl-4-[(1R,3aS,10aR,10bS)-2-(pyridine-3-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-[(pyridin-3-yl)methyl]butanamide
Chemical Structure Depiction of
N-methyl-4-[(1R,3aS,10aR,10bS)-2-(pyridine-3-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-[(pyridin-3-yl)methyl]butanamide
N-methyl-4-[(1R,3aS,10aR,10bS)-2-(pyridine-3-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-[(pyridin-3-yl)methyl]butanamide
Compound characteristics
| Compound ID: | N121-1063 |
| Compound Name: | N-methyl-4-[(1R,3aS,10aR,10bS)-2-(pyridine-3-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-[(pyridin-3-yl)methyl]butanamide |
| Molecular Weight: | 475.63 |
| Molecular Formula: | C28 H37 N5 O2 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(N(C)Cc2cccnc2)=O)N(C1)C(c1cccnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.3075 |
| logD: | -1.1542 |
| logSw: | -1.1049 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.852 |
| InChI Key: | CIJPNKBTCWTVCW-DLGLWYJGSA-N |