4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8009-7311 |
| Compound Name: | 4-cyclohexyl-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 289.4 |
| Molecular Formula: | C15 H19 N3 O S |
| Smiles: | COc1ccc(cc1)c1nnc(n1C1CCCCC1)S |
| Stereo: | ACHIRAL |
| logP: | 4.0022 |
| logD: | 3.8209 |
| logSw: | -4.1349 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.35 |
| InChI Key: | NSAJUYMRPAVLGA-UHFFFAOYSA-N |