4-[4-cyano-3-(trifluoromethyl)phenyl]-1-[(3-fluorophenyl)acetyl]piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-[(3-fluorophenyl)acetyl]piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-[(3-fluorophenyl)acetyl]piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5026 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-1-[(3-fluorophenyl)acetyl]piperazine-2-carboxamide |
| Molecular Weight: | 434.39 |
| Molecular Formula: | C21 H18 F4 N4 O2 |
| Smiles: | C(C(N1CCN(CC1C(N)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O)c1cccc(c1)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3441 |
| logD: | 2.3441 |
| logSw: | -2.8054 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.362 |
| InChI Key: | QDNGEJIINIJIFT-SFHVURJKSA-N |