4-(4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}butanoyl)piperazin-2-one
Chemical Structure Depiction of
4-(4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}butanoyl)piperazin-2-one
4-(4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}butanoyl)piperazin-2-one
Compound characteristics
| Compound ID: | N121-0671 |
| Compound Name: | 4-(4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}butanoyl)piperazin-2-one |
| Molecular Weight: | 439.6 |
| Molecular Formula: | C25 H37 N5 O2 |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(N2CCNC(C2)=O)=O)N(Cc2cccnc2)C1 |
| Stereo: | ABSOLUTE |
| logP: | -0.2354 |
| logD: | -1.4455 |
| logSw: | -1.0813 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.038 |
| InChI Key: | QSWRLSTUQRHLCT-NMOFPLQQSA-N |