2-[4-(but-2-ynoyl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[4-(but-2-ynoyl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
2-[4-(but-2-ynoyl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | T001-1457 |
| Compound Name: | 2-[4-(but-2-ynoyl)piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 353.34 |
| Molecular Formula: | C17 H18 F3 N3 O2 |
| Smiles: | CC#CC(N1CCN(CC1)CC(Nc1ccccc1C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5247 |
| logD: | 2.5247 |
| logSw: | -3.0441 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.623 |
| InChI Key: | OZFGVASICROSDF-UHFFFAOYSA-N |