1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-methoxyphenyl)ethan-1-one
1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | Y031-8208 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 281.35 |
| Molecular Formula: | C18 H19 N O2 |
| Smiles: | COc1ccc(CC(N2CCc3ccccc3C2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3212 |
| logD: | 3.3212 |
| logSw: | -3.3293 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.565 |
| InChI Key: | KCKUULIJQMLXLI-UHFFFAOYSA-N |