N-(3-chlorophenyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide
N-(3-chlorophenyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | K062-0031 |
| Compound Name: | N-(3-chlorophenyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 428.8 |
| Molecular Formula: | C18 H16 Cl F3 N4 O3 |
| Smiles: | C1CN(CCN1C(Nc1cccc(c1)[Cl])=O)c1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.6188 |
| logD: | 4.6188 |
| logSw: | -4.7571 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.748 |
| InChI Key: | BJPFFERUYLKRCO-UHFFFAOYSA-N |