5-({[5-(4-chlorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-methoxyphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-({[5-(4-chlorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-methoxyphenyl)-1,2,4-oxadiazole
5-({[5-(4-chlorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-methoxyphenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D065-0168 |
| Compound Name: | 5-({[5-(4-chlorophenyl)-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-methoxyphenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 493.95 |
| Molecular Formula: | C24 H17 Cl F N5 O2 S |
| Smiles: | COc1ccc(cc1)c1nc(CSc2nnc(c3ccc(cc3)[Cl])n2c2ccc(cc2)F)on1 |
| Stereo: | ACHIRAL |
| logP: | 6.5425 |
| logD: | 6.5425 |
| logSw: | -6.7202 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.599 |
| InChI Key: | XBYYKBWBUIEMQA-UHFFFAOYSA-N |