1-[4-(4-chlorophenyl)piperazin-1-yl]-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-chlorophenyl)piperazin-1-yl]-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
1-[4-(4-chlorophenyl)piperazin-1-yl]-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | F019-0329 |
| Compound Name: | 1-[4-(4-chlorophenyl)piperazin-1-yl]-2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 490.03 |
| Molecular Formula: | C26 H24 Cl N5 O S |
| Smiles: | C1CN(CCN1C(CSc1nnc(c2ccccc2)n1c1ccccc1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1753 |
| logD: | 5.1753 |
| logSw: | -5.7541 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.365 |
| InChI Key: | JOWUQCSBSNHUJT-UHFFFAOYSA-N |