1-[3-(difluoromethoxy)phenyl]-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Chemical Structure Depiction of
1-[3-(difluoromethoxy)phenyl]-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
1-[3-(difluoromethoxy)phenyl]-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | Y500-3877 |
| Compound Name: | 1-[3-(difluoromethoxy)phenyl]-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-en-1-one |
| Molecular Weight: | 320.34 |
| Molecular Formula: | C17 H18 F2 N2 O2 |
| Smiles: | CCn1c(C)c(/C=C/C(c2cccc(c2)OC(F)F)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.6784 |
| logD: | 2.6784 |
| logSw: | -2.7598 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.097 |
| InChI Key: | XMQRUZUHAPEWGS-UHFFFAOYSA-N |