1-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one
Chemical Structure Depiction of
1-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one
1-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one
Compound characteristics
| Compound ID: | V017-7768 |
| Compound Name: | 1-[1-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one |
| Molecular Weight: | 469.62 |
| Molecular Formula: | C28 H39 N O5 |
| Smiles: | CC(CC(N1CCc2cc(c(cc2C1c1ccc(c(c1)OC)OC)OC)OC)=O)CC(C)(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1436 |
| logD: | 5.1436 |
| logSw: | -5.087 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.127 |
| InChI Key: | JZPKUBDNGWVYBZ-UHFFFAOYSA-N |