1-{4-[5-(2-chlorophenyl)furan-2-carbothioyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[5-(2-chlorophenyl)furan-2-carbothioyl]piperazin-1-yl}ethan-1-one
1-{4-[5-(2-chlorophenyl)furan-2-carbothioyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | 3341-0023 |
| Compound Name: | 1-{4-[5-(2-chlorophenyl)furan-2-carbothioyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 348.85 |
| Molecular Formula: | C17 H17 Cl N2 O2 S |
| Smiles: | CC(N1CCN(CC1)C(c1ccc(c2ccccc2[Cl])o1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5368 |
| logD: | 3.5368 |
| logSw: | -3.8328 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 27.7818 |
| InChI Key: | NERYHWNBPYLNQU-UHFFFAOYSA-N |