1-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-(2-methylphenyl)ethan-1-one
1-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-(2-methylphenyl)ethan-1-one
Compound characteristics
Compound ID: | Y206-4748 |
Compound Name: | 1-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-(2-methylphenyl)ethan-1-one |
Molecular Weight: | 262.74 |
Molecular Formula: | C14 H15 Cl N2 O |
Smiles: | Cc1ccccc1CC(n1c(C)c(c(C)n1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.1084 |
logD: | 3.089 |
logSw: | -3.5682 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 27.3248 |
InChI Key: | JDPSAXLWIAWYPW-UHFFFAOYSA-N |