1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(methanesulfonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(methanesulfonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(methanesulfonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0504 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(methanesulfonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide |
| Molecular Weight: | 434.44 |
| Molecular Formula: | C17 H21 F3 N4 O4 S |
| Smiles: | COCCNC(C1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)S(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9592 |
| logD: | 0.9592 |
| logSw: | -2.4873 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.526 |
| InChI Key: | KDIMOTCRNMLOQW-HNNXBMFYSA-N |