2,2'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(sulfanediyl)]bis[N-(4-methylphenyl)acetamide]
Chemical Structure Depiction of
2,2'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(sulfanediyl)]bis[N-(4-methylphenyl)acetamide]
2,2'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(sulfanediyl)]bis[N-(4-methylphenyl)acetamide]
Compound characteristics
| Compound ID: | 8013-2097 |
| Compound Name: | 2,2'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(sulfanediyl)]bis[N-(4-methylphenyl)acetamide] |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C20 H22 N6 O2 S2 |
| Smiles: | Cc1ccc(cc1)NC(CSc1nnc(n1N)SCC(Nc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1653 |
| logD: | 3.1653 |
| logSw: | -3.3264 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 89.02 |
| InChI Key: | QLONDIITILYFPJ-UHFFFAOYSA-N |