2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}-N-[3-(trifluoromethyl)phenyl]acetamide
2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | G856-9387 |
| Compound Name: | 2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 402.37 |
| Molecular Formula: | C21 H17 F3 N2 O3 |
| Smiles: | C=CCN1C=Cc2c(cccc2OCC(Nc2cccc(c2)C(F)(F)F)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.9312 |
| logD: | 3.9307 |
| logSw: | -4.2446 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.395 |
| InChI Key: | FLCIMMMGAZVLHN-UHFFFAOYSA-N |