1-[6,7-dimethoxy-1-(propan-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one
Chemical Structure Depiction of
1-[6,7-dimethoxy-1-(propan-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one
1-[6,7-dimethoxy-1-(propan-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one
Compound characteristics
| Compound ID: | V009-0345 |
| Compound Name: | 1-[6,7-dimethoxy-1-(propan-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one |
| Molecular Weight: | 375.55 |
| Molecular Formula: | C23 H37 N O3 |
| Smiles: | CC(CC(N1CCc2cc(c(cc2C1C(C)C)OC)OC)=O)CC(C)(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9597 |
| logD: | 4.9597 |
| logSw: | -4.5208 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.1378 |
| InChI Key: | DVVGBGRSIPPODW-UHFFFAOYSA-N |