3-{[(3-fluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(3-fluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole
3-{[(3-fluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y206-7282 |
| Compound Name: | 3-{[(3-fluorophenyl)methyl]sulfanyl}-5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 329.39 |
| Molecular Formula: | C17 H16 F N3 O S |
| Smiles: | Cn1c(c2ccc(cc2)OC)nnc1SCc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 3.9215 |
| logD: | 3.9215 |
| logSw: | -4.0914 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.595 |
| InChI Key: | PYTKXAOJJBCAHE-UHFFFAOYSA-N |