1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-ethylhexan-1-one
Chemical Structure Depiction of
1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-ethylhexan-1-one
1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-ethylhexan-1-one
Compound characteristics
| Compound ID: | V008-5664 |
| Compound Name: | 1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-ethylhexan-1-one |
| Molecular Weight: | 369.93 |
| Molecular Formula: | C23 H28 Cl N O |
| Smiles: | CCCCC(CC)C(N1CCc2ccccc2C1c1ccccc1[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.9289 |
| logD: | 6.9289 |
| logSw: | -6.291 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 16.1328 |
| InChI Key: | XIUZOFWVFFNRCE-UHFFFAOYSA-N |