4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclohexyl-N~2~-methylpiperazine-1,2-dicarboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclohexyl-N~2~-methylpiperazine-1,2-dicarboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclohexyl-N~2~-methylpiperazine-1,2-dicarboxamide
Compound characteristics
| Compound ID: | S951-5166 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclohexyl-N~2~-methylpiperazine-1,2-dicarboxamide |
| Molecular Weight: | 437.46 |
| Molecular Formula: | C21 H26 F3 N5 O2 |
| Smiles: | CNC(C1CN(CCN1C(NC1CCCCC1)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.815 |
| logD: | 2.815 |
| logSw: | -3.3341 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.534 |
| InChI Key: | LIXNMQGUCFTHFP-SFHVURJKSA-N |