2-{3-[(3,4-dimethoxyanilino)methyl]-7-methyl-2-oxoquinolin-1(2H)-yl}-N-phenylacetamide
Chemical Structure Depiction of
2-{3-[(3,4-dimethoxyanilino)methyl]-7-methyl-2-oxoquinolin-1(2H)-yl}-N-phenylacetamide
2-{3-[(3,4-dimethoxyanilino)methyl]-7-methyl-2-oxoquinolin-1(2H)-yl}-N-phenylacetamide
Compound characteristics
Compound ID: | E894-0988 |
Compound Name: | 2-{3-[(3,4-dimethoxyanilino)methyl]-7-methyl-2-oxoquinolin-1(2H)-yl}-N-phenylacetamide |
Molecular Weight: | 457.53 |
Molecular Formula: | C27 H27 N3 O4 |
Smiles: | Cc1ccc2C=C(CNc3ccc(c(c3)OC)OC)C(N(CC(Nc3ccccc3)=O)c2c1)=O |
Stereo: | ACHIRAL |
logP: | 4.2325 |
logD: | 4.2325 |
logSw: | -4.3438 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 63.986 |
InChI Key: | XXUDJYVEYKAWSV-UHFFFAOYSA-N |