methyl 4-(2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzoate
methyl 4-(2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzoate
Compound characteristics
| Compound ID: | G856-9411 |
| Compound Name: | methyl 4-(2-{[2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzoate |
| Molecular Weight: | 410.43 |
| Molecular Formula: | C22 H22 N2 O6 |
| Smiles: | COCCN1C=Cc2c(cccc2OCC(Nc2ccc(cc2)C(=O)OC)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.3753 |
| logD: | 2.3752 |
| logSw: | -2.9721 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.911 |
| InChI Key: | IGKFMQWGXPMXHV-UHFFFAOYSA-N |