1-[1-(4-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylpentan-1-one
Chemical Structure Depiction of
1-[1-(4-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylpentan-1-one
1-[1-(4-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylpentan-1-one
Compound characteristics
| Compound ID: | V008-9996 |
| Compound Name: | 1-[1-(4-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-methylpentan-1-one |
| Molecular Weight: | 341.88 |
| Molecular Formula: | C21 H24 Cl N O |
| Smiles: | CCCC(C)C(N1CCc2ccccc2C1c1ccc(cc1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9114 |
| logD: | 5.9114 |
| logSw: | -6.2935 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 16.1328 |
| InChI Key: | HZYHRTWZIRNLFE-UHFFFAOYSA-N |