5-(pyridin-4-yl)-4-[(pyridin-3-yl)methyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(pyridin-4-yl)-4-[(pyridin-3-yl)methyl]-4H-1,2,4-triazole-3-thiol
5-(pyridin-4-yl)-4-[(pyridin-3-yl)methyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
Compound ID: | 8019-6168 |
Compound Name: | 5-(pyridin-4-yl)-4-[(pyridin-3-yl)methyl]-4H-1,2,4-triazole-3-thiol |
Molecular Weight: | 269.33 |
Molecular Formula: | C13 H11 N5 S |
Smiles: | C(c1cccnc1)n1c(c2ccncc2)nnc1S |
Stereo: | ACHIRAL |
logP: | 0.9602 |
logD: | 0.3297 |
logSw: | -0.4615 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.66 |
InChI Key: | BJLBBKRPHJGJCP-UHFFFAOYSA-N |