4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(phenylmethanesulfonyl)piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(phenylmethanesulfonyl)piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(phenylmethanesulfonyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5573 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(phenylmethanesulfonyl)piperazine-2-carboxamide |
| Molecular Weight: | 480.51 |
| Molecular Formula: | C22 H23 F3 N4 O3 S |
| Smiles: | CN(C)C(C1CN(CCN1S(Cc1ccccc1)(=O)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9573 |
| logD: | 1.9573 |
| logSw: | -2.933 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.565 |
| InChI Key: | KIQNGKGPOBZWDE-FQEVSTJZSA-N |