2-({[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)pyridine
Chemical Structure Depiction of
2-({[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)pyridine
2-({[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)pyridine
Compound characteristics
| Compound ID: | V001-4841 |
| Compound Name: | 2-({[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)pyridine |
| Molecular Weight: | 378.88 |
| Molecular Formula: | C20 H15 Cl N4 S |
| Salt: | not_available |
| Smiles: | C(c1ccccn1)Sc1nnc(c2ccccc2[Cl])n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.4265 |
| logD: | 4.4244 |
| logSw: | -4.6535 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.256 |
| InChI Key: | SXASJRODSWZUBX-UHFFFAOYSA-N |