3-(2,5-dimethoxyphenyl)-5-({[4-(4-fluorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2,5-dimethoxyphenyl)-5-({[4-(4-fluorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole
3-(2,5-dimethoxyphenyl)-5-({[4-(4-fluorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D141-0147 |
| Compound Name: | 3-(2,5-dimethoxyphenyl)-5-({[4-(4-fluorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole |
| Molecular Weight: | 489.53 |
| Molecular Formula: | C25 H20 F N5 O3 S |
| Smiles: | COc1ccc(c(c1)c1nc(CSc2nnc(c3ccccc3)n2c2ccc(cc2)F)on1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.5037 |
| logD: | 5.5037 |
| logSw: | -5.6443 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.23 |
| InChI Key: | VXWLTIPIPYGYIJ-UHFFFAOYSA-N |