3-[(2-phenoxyethyl)sulfanyl]-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Chemical Structure Depiction of
3-[(2-phenoxyethyl)sulfanyl]-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
3-[(2-phenoxyethyl)sulfanyl]-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Compound characteristics
| Compound ID: | 8018-0794 |
| Compound Name: | 3-[(2-phenoxyethyl)sulfanyl]-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole |
| Molecular Weight: | 261.3 |
| Molecular Formula: | C11 H11 N5 O S |
| Smiles: | C(CSc1nnc2[nH]cnn12)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.0372 |
| logD: | 0.6421 |
| logSw: | -1.9593 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.739 |
| InChI Key: | BDVNFFLNJWEDNN-UHFFFAOYSA-N |