3-{4-[3-(2-hydroxy-6-methoxyquinolin-3-yl)propanoyl]piperazin-1-yl}propanenitrile
Chemical Structure Depiction of
3-{4-[3-(2-hydroxy-6-methoxyquinolin-3-yl)propanoyl]piperazin-1-yl}propanenitrile
3-{4-[3-(2-hydroxy-6-methoxyquinolin-3-yl)propanoyl]piperazin-1-yl}propanenitrile
Compound characteristics
Compound ID: | P635-0244 |
Compound Name: | 3-{4-[3-(2-hydroxy-6-methoxyquinolin-3-yl)propanoyl]piperazin-1-yl}propanenitrile |
Molecular Weight: | 368.43 |
Molecular Formula: | C20 H24 N4 O3 |
Smiles: | COc1ccc2c(c1)cc(CCC(N1CCN(CCC#N)CC1)=O)c(n2)O |
Stereo: | ACHIRAL |
logP: | 1.1318 |
logD: | 1.1219 |
logSw: | -2.0863 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.476 |
InChI Key: | LMFNANWJJWKBOB-UHFFFAOYSA-N |