5-({[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-ethoxyphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-({[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-ethoxyphenyl)-1,2,4-oxadiazole
5-({[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-ethoxyphenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D141-0255 |
| Compound Name: | 5-({[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-ethoxyphenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 427.91 |
| Molecular Formula: | C20 H18 Cl N5 O2 S |
| Smiles: | CCOc1ccc(cc1)c1nc(CSc2nnc(c3ccc(cc3)[Cl])n2C)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.3273 |
| logD: | 5.3273 |
| logSw: | -6.0642 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.517 |
| InChI Key: | XTQQXPQJBSMTDV-UHFFFAOYSA-N |