1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(phenoxyacetyl)piperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(phenoxyacetyl)piperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(phenoxyacetyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0231 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-4-(phenoxyacetyl)piperazine-2-carboxamide |
| Molecular Weight: | 446.43 |
| Molecular Formula: | C22 H21 F3 N4 O3 |
| Smiles: | CNC(C1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)C(COc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8835 |
| logD: | 1.8835 |
| logSw: | -2.8602 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.638 |
| InChI Key: | PDLZJJWQXUYZRS-IBGZPJMESA-N |