4-[5-({[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]pyridine
Chemical Structure Depiction of
4-[5-({[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]pyridine
4-[5-({[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]pyridine
Compound characteristics
| Compound ID: | D141-0115 |
| Compound Name: | 4-[5-({[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]pyridine |
| Molecular Weight: | 486.55 |
| Molecular Formula: | C25 H22 N6 O3 S |
| Smiles: | CCOc1ccccc1c1nc(CSc2nnc(c3ccncc3)n2c2ccc(cc2)OC)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.6572 |
| logD: | 4.6572 |
| logSw: | -4.4798 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.238 |
| InChI Key: | CBKOKRNEOMCKDE-UHFFFAOYSA-N |