3-ethyl-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
3-ethyl-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
3-ethyl-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | 4298-0309 |
| Compound Name: | 3-ethyl-5-{[(4-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole |
| Molecular Weight: | 249.33 |
| Molecular Formula: | C12 H15 N3 O S |
| Smiles: | CCc1nnc([nH]1)SCc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 1.9083 |
| logD: | 1.5582 |
| logSw: | -2.3116 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.28 |
| InChI Key: | TVNDHCGSGPVWET-UHFFFAOYSA-N |