{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}(3-fluorophenyl)methanone
Chemical Structure Depiction of
{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}(3-fluorophenyl)methanone
{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}(3-fluorophenyl)methanone
Compound characteristics
| Compound ID: | V029-6126 |
| Compound Name: | {6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}(3-fluorophenyl)methanone |
| Molecular Weight: | 459.44 |
| Molecular Formula: | C25 H21 F4 N O3 |
| Smiles: | COc1cc2CCN(C(c3cccc(c3)C(F)(F)F)c2cc1OC)C(c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1587 |
| logD: | 5.1587 |
| logSw: | -5.2258 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.1221 |
| InChI Key: | KDOYSYXOQMYJBF-QHCPKHFHSA-N |