2,2'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(sulfanediyl)]bis[N-(3-methoxyphenyl)acetamide]
Chemical Structure Depiction of
2,2'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(sulfanediyl)]bis[N-(3-methoxyphenyl)acetamide]
2,2'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(sulfanediyl)]bis[N-(3-methoxyphenyl)acetamide]
Compound characteristics
| Compound ID: | 8017-6828 |
| Compound Name: | 2,2'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(sulfanediyl)]bis[N-(3-methoxyphenyl)acetamide] |
| Molecular Weight: | 474.56 |
| Molecular Formula: | C20 H22 N6 O4 S2 |
| Smiles: | COc1cccc(c1)NC(CSc1nnc(n1N)SCC(Nc1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4514 |
| logD: | 2.4514 |
| logSw: | -2.9434 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 104.107 |
| InChI Key: | LCEYIFXWQXMBSE-UHFFFAOYSA-N |