1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-N-methylpiperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-N-methylpiperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-N-methylpiperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0317 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(5-cyclopropyl-1H-pyrazole-3-carbonyl)-N-methylpiperazine-2-carboxamide |
| Molecular Weight: | 446.43 |
| Molecular Formula: | C21 H21 F3 N6 O2 |
| Smiles: | CNC(C1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)C(c1cc(C2CC2)[nH]n1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0956 |
| logD: | 2.0956 |
| logSw: | -3.0168 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.679 |
| InChI Key: | ZUBUYNKPRIIPDR-SFHVURJKSA-N |