1-{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenoxypropan-1-one
Chemical Structure Depiction of
1-{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenoxypropan-1-one
1-{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenoxypropan-1-one
Compound characteristics
| Compound ID: | V010-9347 |
| Compound Name: | 1-{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenoxypropan-1-one |
| Molecular Weight: | 485.5 |
| Molecular Formula: | C27 H26 F3 N O4 |
| Smiles: | CC(C(N1CCc2cc(c(cc2C1c1cccc(c1)C(F)(F)F)OC)OC)=O)Oc1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3448 |
| logD: | 5.3448 |
| logSw: | -5.4826 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.911 |
| InChI Key: | DJVKQSOEBRXEJI-UHFFFAOYSA-N |