4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-N-methylpiperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-N-methylpiperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-N-methylpiperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5271 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(1,3-dimethyl-1H-pyrazole-5-carbonyl)-N-methylpiperazine-2-carboxamide |
| Molecular Weight: | 434.42 |
| Molecular Formula: | C20 H21 F3 N6 O2 |
| Smiles: | Cc1cc(C(N2CCN(CC2C(NC)=O)c2ccc(C#N)c(c2)C(F)(F)F)=O)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7418 |
| logD: | 0.7418 |
| logSw: | -2.2887 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.988 |
| InChI Key: | BALBJZAENMVDFJ-KRWDZBQOSA-N |