5-(3-bromophenyl)-4-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(3-bromophenyl)-4-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
5-(3-bromophenyl)-4-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8019-9323 |
| Compound Name: | 5-(3-bromophenyl)-4-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 333.21 |
| Molecular Formula: | C13 H9 Br N4 S |
| Smiles: | c1cc(cc(c1)[Br])c1nnc(n1c1cccnc1)S |
| Stereo: | ACHIRAL |
| logP: | 3.0601 |
| logD: | 1.8028 |
| logSw: | -2.8525 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.975 |
| InChI Key: | MGZWGNBSJYAAJJ-UHFFFAOYSA-N |