2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one
2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | D419-0006 |
| Compound Name: | 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C26 H24 F N5 O S |
| Smiles: | C1CN(CCN1C(CSc1nnc(c2ccccc2)n1c1ccccc1)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.6097 |
| logD: | 4.6097 |
| logSw: | -4.397 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.365 |
| InChI Key: | MIOQDEHPRYHDGP-UHFFFAOYSA-N |