4-({[3,4-bis(benzyloxy)phenyl]methylidene}amino)-5-ethyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-({[3,4-bis(benzyloxy)phenyl]methylidene}amino)-5-ethyl-4H-1,2,4-triazole-3-thiol
4-({[3,4-bis(benzyloxy)phenyl]methylidene}amino)-5-ethyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8016-0865 |
| Compound Name: | 4-({[3,4-bis(benzyloxy)phenyl]methylidene}amino)-5-ethyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C25 H24 N4 O2 S |
| Smiles: | CCc1nnc(n1/N=C/c1ccc(c(c1)OCc1ccccc1)OCc1ccccc1)S |
| Stereo: | ACHIRAL |
| logP: | 4.2951 |
| logD: | 3.5493 |
| logSw: | -4.579 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.955 |
| InChI Key: | NJQGLEMIZLJEQA-UHFFFAOYSA-N |