1-(4-fluorophenyl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(4-fluorophenyl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
1-(4-fluorophenyl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 8010-5219 |
| Compound Name: | 1-(4-fluorophenyl)-2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 251.28 |
| Molecular Formula: | C11 H10 F N3 O S |
| Smiles: | Cn1cnnc1SCC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.352 |
| logD: | 1.352 |
| logSw: | -2.1132 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.979 |
| InChI Key: | LPATVBNPJAUWJM-UHFFFAOYSA-N |