N-{3-[(adamantan-1-yl)oxy]propyl}-2-(pyridin-3-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[(adamantan-1-yl)oxy]propyl}-2-(pyridin-3-yl)quinoline-4-carboxamide
N-{3-[(adamantan-1-yl)oxy]propyl}-2-(pyridin-3-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | G547-0678 |
| Compound Name: | N-{3-[(adamantan-1-yl)oxy]propyl}-2-(pyridin-3-yl)quinoline-4-carboxamide |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C28 H31 N3 O2 |
| Smiles: | C(CNC(c1cc(c2cccnc2)nc2ccccc12)=O)COC12CC3CC(CC(C3)C2)C1 |
| Stereo: | ACHIRAL |
| logP: | 5.587 |
| logD: | 5.5846 |
| logSw: | -5.984 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.331 |
| InChI Key: | KZHTZOIKVNUCSP-UHFFFAOYSA-N |