4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(methanesulfonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(methanesulfonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(methanesulfonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5472 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-1-(methanesulfonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide |
| Molecular Weight: | 434.44 |
| Molecular Formula: | C17 H21 F3 N4 O4 S |
| Smiles: | COCCNC(C1CN(CCN1S(C)(=O)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9478 |
| logD: | 0.9478 |
| logSw: | -2.4808 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.303 |
| InChI Key: | TUTHWHDVZCNNRB-HNNXBMFYSA-N |