[6,7-dimethoxy-1-{[3-(trifluoromethyl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl][4-(pyrrolidine-1-sulfonyl)phenyl]methanone
Chemical Structure Depiction of
[6,7-dimethoxy-1-{[3-(trifluoromethyl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl][4-(pyrrolidine-1-sulfonyl)phenyl]methanone
[6,7-dimethoxy-1-{[3-(trifluoromethyl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl][4-(pyrrolidine-1-sulfonyl)phenyl]methanone
Compound characteristics
| Compound ID: | K407-0360 |
| Compound Name: | [6,7-dimethoxy-1-{[3-(trifluoromethyl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl][4-(pyrrolidine-1-sulfonyl)phenyl]methanone |
| Molecular Weight: | 604.65 |
| Molecular Formula: | C30 H31 F3 N2 O6 S |
| Smiles: | COc1cc2CCN(C(COc3cccc(c3)C(F)(F)F)c2cc1OC)C(c1ccc(cc1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7629 |
| logD: | 4.7629 |
| logSw: | -4.5525 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.65 |
| InChI Key: | SNYVFFIJMNHGDN-SANMLTNESA-N |