1-(4-chlorophenyl)-6,7-diethoxy-2-[3-(trifluoromethyl)phenyl]-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-6,7-diethoxy-2-[3-(trifluoromethyl)phenyl]-1,4-dihydroisoquinolin-3(2H)-one
1-(4-chlorophenyl)-6,7-diethoxy-2-[3-(trifluoromethyl)phenyl]-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
| Compound ID: | D145-2211 |
| Compound Name: | 1-(4-chlorophenyl)-6,7-diethoxy-2-[3-(trifluoromethyl)phenyl]-1,4-dihydroisoquinolin-3(2H)-one |
| Molecular Weight: | 489.92 |
| Molecular Formula: | C26 H23 Cl F3 N O3 |
| Smiles: | CCOc1cc2CC(N(C(c3ccc(cc3)[Cl])c2cc1OCC)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7392 |
| logD: | 5.7392 |
| logSw: | -6.2241 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.7379 |
| InChI Key: | MHRZVANSVKBLCV-VWLOTQADSA-N |