2-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-chlorophenyl)ethyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-chlorophenyl)ethyl]quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-chlorophenyl)ethyl]quinoline-4-carboxamide
Compound characteristics
Compound ID: | V031-2643 |
Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-chlorophenyl)ethyl]quinoline-4-carboxamide |
Molecular Weight: | 430.89 |
Molecular Formula: | C25 H19 Cl N2 O3 |
Salt: | not_available |
Smiles: | C(CNC(c1cc(c2ccc3c(c2)OCO3)nc2ccccc12)=O)c1ccc(cc1)[Cl] |
Stereo: | ACHIRAL |
logP: | 5.8462 |
logD: | 5.8453 |
logSw: | -6.1033 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.668 |
InChI Key: | IRPQOBPTKOXHMB-UHFFFAOYSA-N |