1-[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]butan-1-one
Chemical Structure Depiction of
1-[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]butan-1-one
1-[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]butan-1-one
Compound characteristics
| Compound ID: | K407-0420 |
| Compound Name: | 1-[6,7-dimethoxy-1-{[4-(propan-2-yl)phenoxy]methyl}-3,4-dihydroisoquinolin-2(1H)-yl]butan-1-one |
| Molecular Weight: | 411.54 |
| Molecular Formula: | C25 H33 N O4 |
| Smiles: | CCCC(N1CCc2cc(c(cc2C1COc1ccc(cc1)C(C)C)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1508 |
| logD: | 5.1508 |
| logSw: | -5.0528 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.318 |
| InChI Key: | FBDDFSHMBQRHAA-QFIPXVFZSA-N |