2-(2-nitrophenyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(2-nitrophenyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
2-(2-nitrophenyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | Y032-1978 |
| Compound Name: | 2-(2-nitrophenyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 393.36 |
| Molecular Formula: | C19 H18 F3 N3 O3 |
| Smiles: | C(C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O)c1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8626 |
| logD: | 3.8626 |
| logSw: | -4.2471 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.7 |
| InChI Key: | XCOOUXVJHQNCNH-UHFFFAOYSA-N |