1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylbutan-1-one
Chemical Structure Depiction of
1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylbutan-1-one
1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylbutan-1-one
Compound characteristics
| Compound ID: | V008-0564 |
| Compound Name: | 1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylbutan-1-one |
| Molecular Weight: | 327.85 |
| Molecular Formula: | C20 H22 Cl N O |
| Smiles: | CCC(C)C(N1CCc2ccccc2C1c1ccccc1[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5762 |
| logD: | 5.5762 |
| logSw: | -5.8391 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 16.1328 |
| InChI Key: | YMGHUKJTHLMGDH-UHFFFAOYSA-N |