1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]piperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]piperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0312 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]piperazine-2-carboxamide |
| Molecular Weight: | 448.45 |
| Molecular Formula: | C21 H23 F3 N6 O2 |
| Smiles: | Cc1cnn(CCC(N2CCN(C(C2)C(NC)=O)c2ccc(C#N)c(c2)C(F)(F)F)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0078 |
| logD: | 1.0078 |
| logSw: | -2.2594 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.894 |
| InChI Key: | LNBVBMPWZRYIBT-SFHVURJKSA-N |