4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-1-(oxane-4-carbonyl)piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-1-(oxane-4-carbonyl)piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-1-(oxane-4-carbonyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5446 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-1-(oxane-4-carbonyl)piperazine-2-carboxamide |
| Molecular Weight: | 468.48 |
| Molecular Formula: | C22 H27 F3 N4 O4 |
| Smiles: | COCCNC(C1CN(CCN1C(C1CCOCC1)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6834 |
| logD: | 1.6834 |
| logSw: | -2.4684 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.8 |
| InChI Key: | FLJBDHKRQGKHIY-IBGZPJMESA-N |