1-[(9H-[1,2,4]triazolo[4,3-a]benzimidazol-3-yl)sulfanyl]propan-2-one
Chemical Structure Depiction of
1-[(9H-[1,2,4]triazolo[4,3-a]benzimidazol-3-yl)sulfanyl]propan-2-one
1-[(9H-[1,2,4]triazolo[4,3-a]benzimidazol-3-yl)sulfanyl]propan-2-one
Compound characteristics
| Compound ID: | 8018-0771 |
| Compound Name: | 1-[(9H-[1,2,4]triazolo[4,3-a]benzimidazol-3-yl)sulfanyl]propan-2-one |
| Molecular Weight: | 246.29 |
| Molecular Formula: | C11 H10 N4 O S |
| Smiles: | CC(CSc1nnc2[nH]c3ccccc3n12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2008 |
| logD: | 1.2 |
| logSw: | -2.1161 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.737 |
| InChI Key: | YUSMDBRLCBIPRI-UHFFFAOYSA-N |