2-[4-(but-2-ynoyl)piperazin-1-yl]-N-(2-chlorophenyl)acetamide
Chemical Structure Depiction of
2-[4-(but-2-ynoyl)piperazin-1-yl]-N-(2-chlorophenyl)acetamide
2-[4-(but-2-ynoyl)piperazin-1-yl]-N-(2-chlorophenyl)acetamide
Compound characteristics
| Compound ID: | T001-1501 |
| Compound Name: | 2-[4-(but-2-ynoyl)piperazin-1-yl]-N-(2-chlorophenyl)acetamide |
| Molecular Weight: | 319.79 |
| Molecular Formula: | C16 H18 Cl N3 O2 |
| Smiles: | CC#CC(N1CCN(CC1)CC(Nc1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0598 |
| logD: | 2.0596 |
| logSw: | -2.6992 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.623 |
| InChI Key: | KKLFELOKDKRWIS-UHFFFAOYSA-N |