{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,2-dimethylquinolin-1(2H)-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,2-dimethylquinolin-1(2H)-yl}(phenyl)methanone
{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,2-dimethylquinolin-1(2H)-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | Y021-0877 |
| Compound Name: | {4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2,2-dimethylquinolin-1(2H)-yl}(phenyl)methanone |
| Molecular Weight: | 408.54 |
| Molecular Formula: | C28 H28 N2 O |
| Smiles: | CC1(C)C=C(CN2CCc3ccccc3C2)c2ccccc2N1C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5171 |
| logD: | 5.0313 |
| logSw: | -5.5025 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 17.7185 |
| InChI Key: | WSRARBWLKLAVQZ-UHFFFAOYSA-N |