N-benzyl-4-[(1R,3aS,10aR,10bS)-2-(oxane-4-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butanamide
Chemical Structure Depiction of
N-benzyl-4-[(1R,3aS,10aR,10bS)-2-(oxane-4-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butanamide
N-benzyl-4-[(1R,3aS,10aR,10bS)-2-(oxane-4-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butanamide
Compound characteristics
| Compound ID: | N106-1312 |
| Compound Name: | N-benzyl-4-[(1R,3aS,10aR,10bS)-2-(oxane-4-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butanamide |
| Molecular Weight: | 467.65 |
| Molecular Formula: | C28 H41 N3 O3 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(NCc2ccccc2)=O)N(C1)C(C1CCOCC1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.2088 |
| logD: | -0.3687 |
| logSw: | -2.5391 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.493 |
| InChI Key: | SYADXYPYGUDSGQ-DLGLWYJGSA-N |