4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-[(4-fluorophenoxy)methyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-[(4-fluorophenoxy)methyl]-4H-1,2,4-triazole-3-thiol
4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-[(4-fluorophenoxy)methyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-3527 |
| Compound Name: | 4-(1,3-dimethyl-1H-pyrazol-4-yl)-5-[(4-fluorophenoxy)methyl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 319.36 |
| Molecular Formula: | C14 H14 F N5 O S |
| Smiles: | Cc1c(cn(C)n1)n1c(COc2ccc(cc2)F)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.0666 |
| logD: | -0.4898 |
| logSw: | -1.4256 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.794 |
| InChI Key: | CNVUJJLHFYSRAW-UHFFFAOYSA-N |