5-({[5-benzyl-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-methylphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-({[5-benzyl-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-methylphenyl)-1,2,4-oxadiazole
5-({[5-benzyl-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-methylphenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D065-0106 |
| Compound Name: | 5-({[5-benzyl-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-methylphenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 473.98 |
| Molecular Formula: | C25 H20 Cl N5 O S |
| Smiles: | Cc1ccc(cc1)c1nc(CSc2nnc(Cc3ccccc3)n2c2ccc(cc2)[Cl])on1 |
| Stereo: | ACHIRAL |
| logP: | 6.5873 |
| logD: | 6.5873 |
| logSw: | -6.4853 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.032 |
| InChI Key: | HMVDPSBMURUMKW-UHFFFAOYSA-N |