3-(2,4-dimethoxyphenyl)-5-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2,4-dimethoxyphenyl)-5-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole
3-(2,4-dimethoxyphenyl)-5-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D141-0180 |
| Compound Name: | 3-(2,4-dimethoxyphenyl)-5-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole |
| Molecular Weight: | 409.47 |
| Molecular Formula: | C20 H19 N5 O3 S |
| Smiles: | Cn1c(c2ccccc2)nnc1SCc1nc(c2ccc(cc2OC)OC)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.9918 |
| logD: | 3.9917 |
| logSw: | -4.3538 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.568 |
| InChI Key: | WYQPLPKVFCSPQZ-UHFFFAOYSA-N |