N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
Compound characteristics
| Compound ID: | G856-9434 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamide |
| Molecular Weight: | 454.83 |
| Molecular Formula: | C21 H18 Cl F3 N2 O4 |
| Smiles: | COCCN1C=Cc2c(cccc2OCC(Nc2cc(ccc2[Cl])C(F)(F)F)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.5095 |
| logD: | 3.4738 |
| logSw: | -4.0044 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.039 |
| InChI Key: | MJJDDHOCKCRQGF-UHFFFAOYSA-N |