6,7-diethoxy-2-[3-(trifluoromethyl)phenyl]-1-(3,4,5-trimethoxyphenyl)-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
6,7-diethoxy-2-[3-(trifluoromethyl)phenyl]-1-(3,4,5-trimethoxyphenyl)-1,4-dihydroisoquinolin-3(2H)-one
6,7-diethoxy-2-[3-(trifluoromethyl)phenyl]-1-(3,4,5-trimethoxyphenyl)-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
| Compound ID: | D145-2185 |
| Compound Name: | 6,7-diethoxy-2-[3-(trifluoromethyl)phenyl]-1-(3,4,5-trimethoxyphenyl)-1,4-dihydroisoquinolin-3(2H)-one |
| Molecular Weight: | 545.56 |
| Molecular Formula: | C29 H30 F3 N O6 |
| Smiles: | CCOc1cc2CC(N(C(c3cc(c(c(c3)OC)OC)OC)c2cc1OCC)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8744 |
| logD: | 4.8744 |
| logSw: | -4.6947 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.716 |
| InChI Key: | QTAIBFRFGQDWFP-MHZLTWQESA-N |