N-[(4-chlorophenyl)methyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide
N-[(4-chlorophenyl)methyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide
Compound characteristics
Compound ID: | C387-0245 |
Compound Name: | N-[(4-chlorophenyl)methyl]-2-(2,4-dimethoxyanilino)quinoline-4-carboxamide |
Molecular Weight: | 447.92 |
Molecular Formula: | C25 H22 Cl N3 O3 |
Smiles: | COc1ccc(c(c1)OC)Nc1cc(C(NCc2ccc(cc2)[Cl])=O)c2ccccc2n1 |
Stereo: | ACHIRAL |
logP: | 5.9767 |
logD: | 5.9633 |
logSw: | -6.0951 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 56.938 |
InChI Key: | AVNXCGMYHIZHJN-UHFFFAOYSA-N |