1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(3-methylbutanoyl)piperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(3-methylbutanoyl)piperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(3-methylbutanoyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0025 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(3-methylbutanoyl)piperazine-2-carboxamide |
| Molecular Weight: | 382.38 |
| Molecular Formula: | C18 H21 F3 N4 O2 |
| Smiles: | CC(C)CC(N1CCN(C(C1)C(N)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8954 |
| logD: | 1.8954 |
| logSw: | -2.772 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.634 |
| InChI Key: | YOYPWGSPMQXVRJ-HNNXBMFYSA-N |