4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclohexylpiperazine-1,3-dicarboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclohexylpiperazine-1,3-dicarboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclohexylpiperazine-1,3-dicarboxamide
Compound characteristics
Compound ID: | S951-0017 |
Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclohexylpiperazine-1,3-dicarboxamide |
Molecular Weight: | 423.44 |
Molecular Formula: | C20 H24 F3 N5 O2 |
Smiles: | C1CCC(CC1)NC(N1CCN(C(C1)C(N)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6274 |
logD: | 2.6274 |
logSw: | -3.1627 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 80.758 |
InChI Key: | ZLTHQHJCLPINQO-KRWDZBQOSA-N |