1-[4-cyano-3-(trifluoromethyl)phenyl]-4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N-methylpiperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N-methylpiperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N-methylpiperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0258 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N-methylpiperazine-2-carboxamide |
| Molecular Weight: | 462.47 |
| Molecular Formula: | C22 H25 F3 N6 O2 |
| Smiles: | Cc1cc(C)n(CCC(N2CCN(C(C2)C(NC)=O)c2ccc(C#N)c(c2)C(F)(F)F)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7261 |
| logD: | 0.7259 |
| logSw: | -2.273 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.124 |
| InChI Key: | XCFKOOGOYALWOS-IBGZPJMESA-N |