1-{4-[(4-chlorophenyl)acetyl]piperazin-1-yl}but-2-yn-1-one
Chemical Structure Depiction of
1-{4-[(4-chlorophenyl)acetyl]piperazin-1-yl}but-2-yn-1-one
1-{4-[(4-chlorophenyl)acetyl]piperazin-1-yl}but-2-yn-1-one
Compound characteristics
| Compound ID: | T002-0023 |
| Compound Name: | 1-{4-[(4-chlorophenyl)acetyl]piperazin-1-yl}but-2-yn-1-one |
| Molecular Weight: | 304.77 |
| Molecular Formula: | C16 H17 Cl N2 O2 |
| Smiles: | CC#CC(N1CCN(CC1)C(Cc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2962 |
| logD: | 2.2962 |
| logSw: | -2.8361 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.56 |
| InChI Key: | IHXVXQBPPCPWEN-UHFFFAOYSA-N |