1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(cyclopentanecarbonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide
Chemical Structure Depiction of
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(cyclopentanecarbonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide
1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(cyclopentanecarbonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide
Compound characteristics
| Compound ID: | S951-0475 |
| Compound Name: | 1-[4-cyano-3-(trifluoromethyl)phenyl]-4-(cyclopentanecarbonyl)-N-(2-methoxyethyl)piperazine-2-carboxamide |
| Molecular Weight: | 452.48 |
| Molecular Formula: | C22 H27 F3 N4 O3 |
| Smiles: | COCCNC(C1CN(CCN1c1ccc(C#N)c(c1)C(F)(F)F)C(C1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6427 |
| logD: | 2.6427 |
| logSw: | -3.0917 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.258 |
| InChI Key: | YSRCKRRLGVNLQP-IBGZPJMESA-N |