2-{[(2-chlorophenyl)methyl]sulfanyl}-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethan-1-one
2-{[(2-chlorophenyl)methyl]sulfanyl}-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | K786-7423 |
| Compound Name: | 2-{[(2-chlorophenyl)methyl]sulfanyl}-1-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 388.96 |
| Molecular Formula: | C21 H25 Cl N2 O S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(CSCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4291 |
| logD: | 5.429 |
| logSw: | -5.862 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 19.3187 |
| InChI Key: | LKCBHLWPAJLDPC-UHFFFAOYSA-N |