2-{[4-ethyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethan-1-one
Chemical Structure Depiction of
2-{[4-ethyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethan-1-one
2-{[4-ethyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | G786-1508 |
| Compound Name: | 2-{[4-ethyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethan-1-one |
| Molecular Weight: | 347.43 |
| Molecular Formula: | C16 H14 F N3 O S2 |
| Smiles: | CCn1c(c2cccs2)nnc1SCC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7061 |
| logD: | 3.7059 |
| logSw: | -3.9613 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.231 |
| InChI Key: | ZOBBMQKRGRNZHR-UHFFFAOYSA-N |