4-[(1R,3aS,10aR,10bS)-2-benzyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-methyl-N-[(pyridin-3-yl)methyl]butanamide
Chemical Structure Depiction of
4-[(1R,3aS,10aR,10bS)-2-benzyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-methyl-N-[(pyridin-3-yl)methyl]butanamide
4-[(1R,3aS,10aR,10bS)-2-benzyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-methyl-N-[(pyridin-3-yl)methyl]butanamide
Compound characteristics
Compound ID: | N121-0567 |
Compound Name: | 4-[(1R,3aS,10aR,10bS)-2-benzyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-methyl-N-[(pyridin-3-yl)methyl]butanamide |
Molecular Weight: | 460.66 |
Molecular Formula: | C29 H40 N4 O |
Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(N(C)Cc2cccnc2)=O)N(Cc2ccccc2)C1 |
Stereo: | ABSOLUTE |
logP: | 2.8985 |
logD: | 1.6884 |
logSw: | -2.8327 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 31.5836 |
InChI Key: | NJDWIHWKVWDWLY-ODNCNNFYSA-N |