4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(4-methylbenzene-1-sulfonyl)piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(4-methylbenzene-1-sulfonyl)piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(4-methylbenzene-1-sulfonyl)piperazine-2-carboxamide
Compound characteristics
Compound ID: | S951-5682 |
Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(4-methylbenzene-1-sulfonyl)piperazine-2-carboxamide |
Molecular Weight: | 480.51 |
Molecular Formula: | C22 H23 F3 N4 O3 S |
Smiles: | Cc1ccc(cc1)S(N1CCN(CC1C(N(C)C)=O)c1ccc(C#N)c(c1)C(F)(F)F)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.7329 |
logD: | 2.7329 |
logSw: | -3.2844 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 68.671 |
InChI Key: | WKJVHUKSLFRYFF-FQEVSTJZSA-N |