4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]butanamide
Chemical Structure Depiction of
4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]butanamide
4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]butanamide
Compound characteristics
| Compound ID: | N121-0703 |
| Compound Name: | 4-{(1R,3aS,10aR,10bS)-2-[(pyridin-3-yl)methyl]decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl}-N-[2-(1,3,5-trimethyl-1H-pyrazol-4-yl)ethyl]butanamide |
| Molecular Weight: | 492.71 |
| Molecular Formula: | C29 H44 N6 O |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(NCCc2c(C)nn(C)c2C)=O)N(Cc2cccnc2)C1 |
| Stereo: | ABSOLUTE |
| logP: | 0.5479 |
| logD: | -0.6622 |
| logSw: | -1.2322 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.841 |
| InChI Key: | LNPYCDHECWSVQG-UNXBZVTQSA-N |