4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclopentyl-N~3~-(2-methoxyethyl)piperazine-1,3-dicarboxamide
Chemical Structure Depiction of
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclopentyl-N~3~-(2-methoxyethyl)piperazine-1,3-dicarboxamide
4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclopentyl-N~3~-(2-methoxyethyl)piperazine-1,3-dicarboxamide
Compound characteristics
| Compound ID: | S951-0524 |
| Compound Name: | 4-[4-cyano-3-(trifluoromethyl)phenyl]-N~1~-cyclopentyl-N~3~-(2-methoxyethyl)piperazine-1,3-dicarboxamide |
| Molecular Weight: | 467.49 |
| Molecular Formula: | C22 H28 F3 N5 O3 |
| Smiles: | COCCNC(C1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)C(NC1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7081 |
| logD: | 2.7081 |
| logSw: | -3.1905 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.934 |
| InChI Key: | FBCKATJTRWQZHA-IBGZPJMESA-N |