4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(propane-1-sulfonyl)piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(propane-1-sulfonyl)piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(propane-1-sulfonyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5578 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N,N-dimethyl-1-(propane-1-sulfonyl)piperazine-2-carboxamide |
| Molecular Weight: | 432.46 |
| Molecular Formula: | C18 H23 F3 N4 O3 S |
| Smiles: | CCCS(N1CCN(CC1C(N(C)C)=O)c1ccc(C#N)c(c1)C(F)(F)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3392 |
| logD: | 1.3392 |
| logSw: | -2.4762 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.837 |
| InChI Key: | UFYJUPXRDVOAKK-INIZCTEOSA-N |