3-(2-ethoxyphenyl)-5-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2-ethoxyphenyl)-5-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole
3-(2-ethoxyphenyl)-5-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D141-0108 |
| Compound Name: | 3-(2-ethoxyphenyl)-5-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C21 H21 N5 O2 S |
| Smiles: | CCn1c(c2ccccc2)nnc1SCc1nc(c2ccccc2OCC)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.8607 |
| logD: | 4.8605 |
| logSw: | -4.6822 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.519 |
| InChI Key: | CTXFOIODADZMMW-UHFFFAOYSA-N |