2-[4-(but-2-ynoyl)piperazin-1-yl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[4-(but-2-ynoyl)piperazin-1-yl]-N-(4-fluorophenyl)acetamide
2-[4-(but-2-ynoyl)piperazin-1-yl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | T001-1489 |
| Compound Name: | 2-[4-(but-2-ynoyl)piperazin-1-yl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 303.33 |
| Molecular Formula: | C16 H18 F N3 O2 |
| Smiles: | CC#CC(N1CCN(CC1)CC(Nc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0381 |
| logD: | 2.038 |
| logSw: | -2.7264 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.321 |
| InChI Key: | VIDCFCKJYLOGIA-UHFFFAOYSA-N |