N-(3-fluorophenyl)-2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
Chemical Structure Depiction of
N-(3-fluorophenyl)-2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
N-(3-fluorophenyl)-2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
Compound characteristics
| Compound ID: | G856-9383 |
| Compound Name: | N-(3-fluorophenyl)-2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamide |
| Molecular Weight: | 352.36 |
| Molecular Formula: | C20 H17 F N2 O3 |
| Smiles: | C=CCN1C=Cc2c(cccc2OCC(Nc2cccc(c2)F)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.0414 |
| logD: | 3.0412 |
| logSw: | -3.5247 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.395 |
| InChI Key: | GAEXQJSGGARVAT-UHFFFAOYSA-N |