1-{1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenoxypropan-1-one
Chemical Structure Depiction of
1-{1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenoxypropan-1-one
1-{1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenoxypropan-1-one
Compound characteristics
| Compound ID: | K407-0422 |
| Compound Name: | 1-{1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenoxypropan-1-one |
| Molecular Weight: | 465.52 |
| Molecular Formula: | C27 H28 F N O5 |
| Smiles: | CC(C(N1CCc2cc(c(cc2C1COc1ccc(cc1)F)OC)OC)=O)Oc1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4268 |
| logD: | 4.4268 |
| logSw: | -4.3124 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.363 |
| InChI Key: | ZEGZFRHQYWGRBW-UHFFFAOYSA-N |