1-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-4-(pyridine-3-sulfonyl)piperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-4-(pyridine-3-sulfonyl)piperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-4-(pyridine-3-sulfonyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0469 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-methoxyethyl)-4-(pyridine-3-sulfonyl)piperazine-2-carboxamide |
| Molecular Weight: | 497.49 |
| Molecular Formula: | C21 H22 F3 N5 O4 S |
| Smiles: | COCCNC(C1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)S(c1cccnc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4871 |
| logD: | 1.4871 |
| logSw: | -2.106 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.28 |
| InChI Key: | DCNMLBBFLMBMDK-IBGZPJMESA-N |