2-(5-{[(3-chlorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine
Chemical Structure Depiction of
2-(5-{[(3-chlorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine
2-(5-{[(3-chlorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine
Compound characteristics
Compound ID: | Y205-9399 |
Compound Name: | 2-(5-{[(3-chlorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine |
Molecular Weight: | 330.84 |
Molecular Formula: | C16 H15 Cl N4 S |
Smiles: | CCn1c(c2ccccn2)nnc1SCc1cccc(c1)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.8421 |
logD: | 3.8419 |
logSw: | -4.0987 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 33.013 |
InChI Key: | FSCHWCYLWWTVTF-UHFFFAOYSA-N |