N-[(3,5-difluorophenyl)methyl]-4-[(1R,3aS,10aR,10bS)-2-methyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butanamide
Chemical Structure Depiction of
N-[(3,5-difluorophenyl)methyl]-4-[(1R,3aS,10aR,10bS)-2-methyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butanamide
N-[(3,5-difluorophenyl)methyl]-4-[(1R,3aS,10aR,10bS)-2-methyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butanamide
Compound characteristics
| Compound ID: | N121-0058 |
| Compound Name: | N-[(3,5-difluorophenyl)methyl]-4-[(1R,3aS,10aR,10bS)-2-methyldecahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]butanamide |
| Molecular Weight: | 405.53 |
| Molecular Formula: | C23 H33 F2 N3 O |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(NCc2cc(cc(c2)F)F)=O)N(C)C1 |
| Stereo: | ABSOLUTE |
| logP: | 2.3427 |
| logD: | 0.9852 |
| logSw: | -2.6051 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.6293 |
| InChI Key: | VDZVGSSHVFKIMM-XMXZMMKCSA-N |