4-ethyl-3-{[(4-fluorophenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
4-ethyl-3-{[(4-fluorophenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazole
4-ethyl-3-{[(4-fluorophenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y206-1626 |
| Compound Name: | 4-ethyl-3-{[(4-fluorophenyl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 251.32 |
| Molecular Formula: | C12 H14 F N3 S |
| Smiles: | CCn1c(C)nnc1SCc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.1466 |
| logD: | 2.1465 |
| logSw: | -2.1553 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.014 |
| InChI Key: | PJIYUFYAWPIOHD-UHFFFAOYSA-N |