2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one
Chemical Structure Depiction of
2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one
2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | 8017-9584 |
| Compound Name: | 2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one |
| Molecular Weight: | 303.79 |
| Molecular Formula: | C16 H18 Cl N3 O |
| Smiles: | Cc1c(c(C)n(CC(N2CCc3ccccc3C2)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.3031 |
| logD: | 2.3031 |
| logSw: | -3.1793 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.5745 |
| InChI Key: | RWABCQWHONPRCM-UHFFFAOYSA-N |