3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazole
Chemical Structure Depiction of
3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazole
3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | D385-0336 |
| Compound Name: | 3-[(2-phenoxyethyl)sulfanyl]-1H-1,2,4-triazole |
| Molecular Weight: | 221.28 |
| Molecular Formula: | C10 H11 N3 O S |
| Smiles: | C(CSc1nc[nH]n1)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6488 |
| logD: | 1.6411 |
| logSw: | -2.0655 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.81 |
| InChI Key: | PVEXANLRJOHITE-UHFFFAOYSA-N |