4-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-1-(pyridine-3-sulfonyl)piperazine-2-carboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-1-(pyridine-3-sulfonyl)piperazine-2-carboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-1-(pyridine-3-sulfonyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-5200 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-methyl-1-(pyridine-3-sulfonyl)piperazine-2-carboxamide |
| Molecular Weight: | 453.44 |
| Molecular Formula: | C19 H18 F3 N5 O3 S |
| Smiles: | CNC(C1CN(CCN1S(c1cccnc1)(=O)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1068 |
| logD: | 1.1068 |
| logSw: | -2.0848 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.023 |
| InChI Key: | XJKVEXIEGVVVDI-KRWDZBQOSA-N |