1-{4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl}-3-[4-(difluoromethoxy)phenyl]prop-2-en-1-one
Chemical Structure Depiction of
1-{4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl}-3-[4-(difluoromethoxy)phenyl]prop-2-en-1-one
1-{4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl}-3-[4-(difluoromethoxy)phenyl]prop-2-en-1-one
Compound characteristics
| Compound ID: | Y502-4871 |
| Compound Name: | 1-{4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl}-3-[4-(difluoromethoxy)phenyl]prop-2-en-1-one |
| Molecular Weight: | 424.85 |
| Molecular Formula: | C21 H20 Cl F3 N2 O2 |
| Smiles: | C1CN(CCN1Cc1ccc(cc1[Cl])F)C(/C=C\c1ccc(cc1)OC(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.079 |
| logD: | 4.0774 |
| logSw: | -4.4867 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.5048 |
| InChI Key: | MAQDLNMZCBHQJO-UHFFFAOYSA-N |