2-(2H-1,3-benzodioxol-5-yl)-N-[2-methyl-6-(propan-2-yl)phenyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-[2-methyl-6-(propan-2-yl)phenyl]quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-[2-methyl-6-(propan-2-yl)phenyl]quinoline-4-carboxamide
Compound characteristics
Compound ID: | Y205-8772 |
Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-[2-methyl-6-(propan-2-yl)phenyl]quinoline-4-carboxamide |
Molecular Weight: | 424.5 |
Molecular Formula: | C27 H24 N2 O3 |
Smiles: | CC(C)c1cccc(C)c1NC(c1cc(c2ccc3c(c2)OCO3)nc2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 5.8223 |
logD: | 5.8223 |
logSw: | -5.7156 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.109 |
InChI Key: | WEABHANXSIURNF-UHFFFAOYSA-N |