1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one
Chemical Structure Depiction of
1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one
1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one
Compound characteristics
| Compound ID: | V008-5710 |
| Compound Name: | 1-[1-(2-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-3,5,5-trimethylhexan-1-one |
| Molecular Weight: | 383.96 |
| Molecular Formula: | C24 H30 Cl N O |
| Smiles: | CC(CC(N1CCc2ccccc2C1c1ccccc1[Cl])=O)CC(C)(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.9084 |
| logD: | 6.9084 |
| logSw: | -6.2762 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 15.6054 |
| InChI Key: | GCFDESZIBGOGBM-UHFFFAOYSA-N |