ethyl 2-(2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzoate
Chemical Structure Depiction of
ethyl 2-(2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzoate
ethyl 2-(2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzoate
Compound characteristics
Compound ID: | G856-9368 |
Compound Name: | ethyl 2-(2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzoate |
Molecular Weight: | 406.44 |
Molecular Formula: | C23 H22 N2 O5 |
Smiles: | CCOC(c1ccccc1NC(COc1cccc2C(N(CC=C)C=Cc12)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1562 |
logD: | 3.1411 |
logSw: | -3.5143 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.451 |
InChI Key: | FLKMDGVVNGLINA-UHFFFAOYSA-N |