5-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole
5-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D065-0103 |
| Compound Name: | 5-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 477.95 |
| Molecular Formula: | C24 H17 Cl F N5 O S |
| Smiles: | C(c1ccccc1)c1nnc(n1c1ccc(cc1)F)SCc1nc(c2ccc(cc2)[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 6.1929 |
| logD: | 6.1929 |
| logSw: | -6.4462 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.032 |
| InChI Key: | ILOMPUSPHRMHIA-UHFFFAOYSA-N |