3-[(prop-2-yn-1-yl)sulfanyl]-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Chemical Structure Depiction of
3-[(prop-2-yn-1-yl)sulfanyl]-9H-[1,2,4]triazolo[4,3-a]benzimidazole
3-[(prop-2-yn-1-yl)sulfanyl]-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Compound characteristics
| Compound ID: | 8019-7971 |
| Compound Name: | 3-[(prop-2-yn-1-yl)sulfanyl]-9H-[1,2,4]triazolo[4,3-a]benzimidazole |
| Molecular Weight: | 228.27 |
| Molecular Formula: | C11 H8 N4 S |
| Smiles: | C#CCSc1nnc2[nH]c3ccccc3n12 |
| Stereo: | ACHIRAL |
| logP: | 1.8751 |
| logD: | 1.8736 |
| logSw: | -1.8631 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.402 |
| InChI Key: | HWWXSLVPXUYJFX-UHFFFAOYSA-N |