3-(2-chloro-6-fluorophenyl)-1-(1,3-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-(2-chloro-6-fluorophenyl)-1-(1,3-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
3-(2-chloro-6-fluorophenyl)-1-(1,3-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-4919 |
| Compound Name: | 3-(2-chloro-6-fluorophenyl)-1-(1,3-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one |
| Molecular Weight: | 278.71 |
| Molecular Formula: | C14 H12 Cl F N2 O |
| Smiles: | Cc1c(cn(C)n1)C(/C=C/c1c(cccc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3739 |
| logD: | 2.3739 |
| logSw: | -3.2261 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 28.3758 |
| InChI Key: | UVXZSGPHKZQJOE-UHFFFAOYSA-N |