4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-1-(2-methylfuran-3-carbonyl)piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-1-(2-methylfuran-3-carbonyl)piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-1-(2-methylfuran-3-carbonyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5451 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-1-(2-methylfuran-3-carbonyl)piperazine-2-carboxamide |
| Molecular Weight: | 464.44 |
| Molecular Formula: | C22 H23 F3 N4 O4 |
| Smiles: | Cc1c(cco1)C(N1CCN(CC1C(NCCOC)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0848 |
| logD: | 2.0848 |
| logSw: | -3.0659 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.932 |
| InChI Key: | PRCQNFWIWXXUTI-IBGZPJMESA-N |