5-{[([1,1'-biphenyl]-4-yl)oxy]methyl}-4-phenyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-{[([1,1'-biphenyl]-4-yl)oxy]methyl}-4-phenyl-4H-1,2,4-triazole-3-thiol
5-{[([1,1'-biphenyl]-4-yl)oxy]methyl}-4-phenyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8011-2007 |
| Compound Name: | 5-{[([1,1'-biphenyl]-4-yl)oxy]methyl}-4-phenyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 359.45 |
| Molecular Formula: | C21 H17 N3 O S |
| Smiles: | C(c1nnc(n1c1ccccc1)S)Oc1ccc(cc1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3318 |
| logD: | 3.0725 |
| logSw: | -4.6544 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.662 |
| InChI Key: | YMTCAUNMUYRNKD-UHFFFAOYSA-N |