2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-(2-cyanophenyl)acetamide
Chemical Structure Depiction of
2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-(2-cyanophenyl)acetamide
2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-(2-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | 8017-2421 |
| Compound Name: | 2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-(2-cyanophenyl)acetamide |
| Molecular Weight: | 314.33 |
| Molecular Formula: | C12 H10 N8 O S |
| Smiles: | C(C(Nc1ccccc1C#N)=O)Sc1nnc2n(cnn12)N |
| Stereo: | ACHIRAL |
| logP: | -0.5713 |
| logD: | -0.5722 |
| logSw: | -2.2467 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.051 |
| InChI Key: | INSPFMWBTARGOO-UHFFFAOYSA-N |