4-(4-chloro-2-methylphenoxy)-1-(3,4-dihydroisoquinolin-2(1H)-yl)butan-1-one
Chemical Structure Depiction of
4-(4-chloro-2-methylphenoxy)-1-(3,4-dihydroisoquinolin-2(1H)-yl)butan-1-one
4-(4-chloro-2-methylphenoxy)-1-(3,4-dihydroisoquinolin-2(1H)-yl)butan-1-one
Compound characteristics
| Compound ID: | Y030-6474 |
| Compound Name: | 4-(4-chloro-2-methylphenoxy)-1-(3,4-dihydroisoquinolin-2(1H)-yl)butan-1-one |
| Molecular Weight: | 343.85 |
| Molecular Formula: | C20 H22 Cl N O2 |
| Smiles: | Cc1cc(ccc1OCCCC(N1CCc2ccccc2C1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0942 |
| logD: | 5.0942 |
| logSw: | -5.257 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.5256 |
| InChI Key: | CRIRQIDXBSUBAH-UHFFFAOYSA-N |