5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol
5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8019-7116 |
| Compound Name: | 5-(4-methoxyphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 221.28 |
| Molecular Formula: | C10 H11 N3 O S |
| Smiles: | Cn1c(c2ccc(cc2)OC)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 2.1571 |
| logD: | 1.4193 |
| logSw: | -2.5993 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.166 |
| InChI Key: | GYQUBNVSGYWROW-UHFFFAOYSA-N |