3-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Chemical Structure Depiction of
3-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-9H-[1,2,4]triazolo[4,3-a]benzimidazole
3-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Compound characteristics
| Compound ID: | 8017-1596 |
| Compound Name: | 3-{[2-(4-chlorophenoxy)ethyl]sulfanyl}-9H-[1,2,4]triazolo[4,3-a]benzimidazole |
| Molecular Weight: | 344.82 |
| Molecular Formula: | C16 H13 Cl N4 O S |
| Smiles: | C(CSc1nnc2[nH]c3ccccc3n12)Oc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5929 |
| logD: | 3.5916 |
| logSw: | -3.895 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.548 |
| InChI Key: | CNKSTGFXCZKNDC-UHFFFAOYSA-N |