3-(4-methylphenyl)-5-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(4-methylphenyl)-5-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole
3-(4-methylphenyl)-5-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | D065-0001 |
| Compound Name: | 3-(4-methylphenyl)-5-{[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazole |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C19 H17 N5 O S |
| Smiles: | Cc1ccc(cc1)c1nc(CSc2nnc(c3ccccc3)n2C)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.682 |
| logD: | 4.6819 |
| logSw: | -4.4933 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.394 |
| InChI Key: | JLLYHBCHROJWEO-UHFFFAOYSA-N |