{1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl}(4-methyl-3-nitrophenyl)methanone
Chemical Structure Depiction of
{1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl}(4-methyl-3-nitrophenyl)methanone
{1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl}(4-methyl-3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | K407-0437 |
| Compound Name: | {1-[(4-fluorophenoxy)methyl]-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl}(4-methyl-3-nitrophenyl)methanone |
| Molecular Weight: | 480.49 |
| Molecular Formula: | C26 H25 F N2 O6 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(N1CCc2cc(c(cc2C1COc1ccc(cc1)F)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4662 |
| logD: | 4.4662 |
| logSw: | -4.3981 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.654 |
| InChI Key: | WEPDREVWFHKHDU-QHCPKHFHSA-N |