4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-(4-methoxyphenyl)piperazine-1,2-dicarboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-(4-methoxyphenyl)piperazine-1,2-dicarboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-(4-methoxyphenyl)piperazine-1,2-dicarboxamide
Compound characteristics
| Compound ID: | S951-5072 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-(4-methoxyphenyl)piperazine-1,2-dicarboxamide |
| Molecular Weight: | 447.42 |
| Molecular Formula: | C21 H20 F3 N5 O3 |
| Smiles: | COc1ccc(cc1)NC(N1CCN(CC1C(N)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2398 |
| logD: | 2.2398 |
| logSw: | -3.1926 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.254 |
| InChI Key: | LFFPKQHCJXNAMD-SFHVURJKSA-N |