N-(3-chloro-4-methylphenyl)-2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
N-(3-chloro-4-methylphenyl)-2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
Compound characteristics
| Compound ID: | G856-9430 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamide |
| Molecular Weight: | 400.86 |
| Molecular Formula: | C21 H21 Cl N2 O4 |
| Smiles: | Cc1ccc(cc1[Cl])NC(COc1cccc2C(N(CCOC)C=Cc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6748 |
| logD: | 3.6746 |
| logSw: | -4.0061 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.737 |
| InChI Key: | BFIOQRWNPHLRLN-UHFFFAOYSA-N |