4-[(1R,3aS,10aR,10bS)-2-(3-methylthiophene-2-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-phenylbutanamide
Chemical Structure Depiction of
4-[(1R,3aS,10aR,10bS)-2-(3-methylthiophene-2-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-phenylbutanamide
4-[(1R,3aS,10aR,10bS)-2-(3-methylthiophene-2-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-phenylbutanamide
Compound characteristics
| Compound ID: | N106-0960 |
| Compound Name: | 4-[(1R,3aS,10aR,10bS)-2-(3-methylthiophene-2-carbonyl)decahydro-1H,4H-pyrido[3,2,1-ij][1,6]naphthyridin-1-yl]-N-phenylbutanamide |
| Molecular Weight: | 465.66 |
| Molecular Formula: | C27 H35 N3 O2 S |
| Smiles: | [H][C@]12CCCN3CCC[C@@]([H])([C@]23[H])[C@@]([H])(CCCC(Nc2ccccc2)=O)N(C1)C(c1c(C)ccs1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.56 |
| logD: | 1.0983 |
| logSw: | -3.7448 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.089 |
| InChI Key: | NMFKHTALCQDLMJ-HBAHCVPVSA-N |