9-phenyl-9H-[1,2,4]triazolo[4,3-a]benzimidazole-3-thiol
Chemical Structure Depiction of
9-phenyl-9H-[1,2,4]triazolo[4,3-a]benzimidazole-3-thiol
9-phenyl-9H-[1,2,4]triazolo[4,3-a]benzimidazole-3-thiol
Compound characteristics
Compound ID: | C456-0074 |
Compound Name: | 9-phenyl-9H-[1,2,4]triazolo[4,3-a]benzimidazole-3-thiol |
Molecular Weight: | 266.32 |
Molecular Formula: | C14 H10 N4 S |
Smiles: | c1ccc(cc1)n1c2ccccc2n2c(nnc12)S |
Stereo: | ACHIRAL |
logP: | 2.4658 |
logD: | 2.4649 |
logSw: | -2.3125 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 24.144 |
InChI Key: | LMZGCEOINURCOO-UHFFFAOYSA-N |