4-[4-(2-chlorophenyl)piperazin-1-yl]-N-(3,5-difluorophenyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-[4-(2-chlorophenyl)piperazin-1-yl]-N-(3,5-difluorophenyl)-3-nitrobenzamide
4-[4-(2-chlorophenyl)piperazin-1-yl]-N-(3,5-difluorophenyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | K781-6787 |
| Compound Name: | 4-[4-(2-chlorophenyl)piperazin-1-yl]-N-(3,5-difluorophenyl)-3-nitrobenzamide |
| Molecular Weight: | 472.88 |
| Molecular Formula: | C23 H19 Cl F2 N4 O3 |
| Smiles: | C1CN(CCN1c1ccc(cc1[N+]([O-])=O)C(Nc1cc(cc(c1)F)F)=O)c1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5745 |
| logD: | 4.267 |
| logSw: | -5.9857 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.521 |
| InChI Key: | XBEWLLFSWXMLBX-UHFFFAOYSA-N |