3-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-[4-(difluoromethoxy)phenyl]prop-2-en-1-one
Chemical Structure Depiction of
3-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-[4-(difluoromethoxy)phenyl]prop-2-en-1-one
3-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-[4-(difluoromethoxy)phenyl]prop-2-en-1-one
Compound characteristics
| Compound ID: | Y509-0057 |
| Compound Name: | 3-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-[4-(difluoromethoxy)phenyl]prop-2-en-1-one |
| Molecular Weight: | 406.86 |
| Molecular Formula: | C21 H21 Cl F2 N2 O2 |
| Smiles: | C1CN(CCN1Cc1ccccc1[Cl])/C=C/C(c1ccc(cc1)OC(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2796 |
| logD: | 3.2762 |
| logSw: | -3.5361 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.9745 |
| InChI Key: | XIVIADOGZLSAQJ-UHFFFAOYSA-N |