3-(5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine
Chemical Structure Depiction of
3-(5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine
3-(5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine
Compound characteristics
Compound ID: | V011-1430 |
Compound Name: | 3-(5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)pyridine |
Molecular Weight: | 372.49 |
Molecular Formula: | C22 H20 N4 S |
Smiles: | Cc1ccc(C)c(CSc2nnc(c3cccnc3)n2c2ccccc2)c1 |
Stereo: | ACHIRAL |
logP: | 5.015 |
logD: | 5.0108 |
logSw: | -4.4815 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 34.23 |
InChI Key: | VVJKKLCZYKVUBJ-UHFFFAOYSA-N |