3-{[(2,5-difluorophenyl)methyl]sulfanyl}-5-(2-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2,5-difluorophenyl)methyl]sulfanyl}-5-(2-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole
3-{[(2,5-difluorophenyl)methyl]sulfanyl}-5-(2-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V009-1135 |
| Compound Name: | 3-{[(2,5-difluorophenyl)methyl]sulfanyl}-5-(2-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 439.48 |
| Molecular Formula: | C23 H19 F2 N3 O2 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)n1c(c2ccccc2OC)nnc1SCc1cc(ccc1F)F |
| Stereo: | ACHIRAL |
| logP: | 5.4645 |
| logD: | 5.4645 |
| logSw: | -5.6093 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.887 |
| InChI Key: | OBXXJNNFGWKMFU-UHFFFAOYSA-N |