1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(2-methylfuran-3-carbonyl)piperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(2-methylfuran-3-carbonyl)piperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(2-methylfuran-3-carbonyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0215 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(2-methylfuran-3-carbonyl)piperazine-2-carboxamide |
| Molecular Weight: | 420.39 |
| Molecular Formula: | C20 H19 F3 N4 O3 |
| Smiles: | Cc1c(cco1)C(N1CCN(C(C1)C(NC)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6409 |
| logD: | 1.6409 |
| logSw: | -2.41 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.899 |
| InChI Key: | ONFUMQFLQZBBEQ-KRWDZBQOSA-N |