1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenylbutan-1-one
Chemical Structure Depiction of
1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenylbutan-1-one
1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenylbutan-1-one
Compound characteristics
| Compound ID: | K407-0610 |
| Compound Name: | 1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}-2-phenylbutan-1-one |
| Molecular Weight: | 475.59 |
| Molecular Formula: | C29 H33 N O5 |
| Smiles: | CCC(C(N1CCc2cc(c(cc2C1COc1ccc(cc1)OC)OC)OC)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1083 |
| logD: | 5.1083 |
| logSw: | -5.0536 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.117 |
| InChI Key: | MKCQZUWOCZBNRY-UHFFFAOYSA-N |