5-(4-methoxyphenyl)-4-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(4-methoxyphenyl)-4-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
5-(4-methoxyphenyl)-4-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8018-6061 |
| Compound Name: | 5-(4-methoxyphenyl)-4-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 284.34 |
| Molecular Formula: | C14 H12 N4 O S |
| Smiles: | COc1ccc(cc1)c1nnc(n1c1cccnc1)S |
| Stereo: | ACHIRAL |
| logP: | 2.1954 |
| logD: | 0.9381 |
| logSw: | -1.8108 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.519 |
| InChI Key: | NPWRXOGFWLAFKG-UHFFFAOYSA-N |