3-{[(2-chlorophenyl)methyl]sulfanyl}-5-(3-methylphenyl)-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-chlorophenyl)methyl]sulfanyl}-5-(3-methylphenyl)-4-phenyl-4H-1,2,4-triazole
3-{[(2-chlorophenyl)methyl]sulfanyl}-5-(3-methylphenyl)-4-phenyl-4H-1,2,4-triazole
Compound characteristics
Compound ID: | V011-0513 |
Compound Name: | 3-{[(2-chlorophenyl)methyl]sulfanyl}-5-(3-methylphenyl)-4-phenyl-4H-1,2,4-triazole |
Molecular Weight: | 391.92 |
Molecular Formula: | C22 H18 Cl N3 S |
Salt: | not_available |
Smiles: | Cc1cccc(c1)c1nnc(n1c1ccccc1)SCc1ccccc1[Cl] |
Stereo: | ACHIRAL |
logP: | 6.2961 |
logD: | 6.2961 |
logSw: | -6.3043 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 24.7125 |
InChI Key: | FUFPNIJVXHOPBB-UHFFFAOYSA-N |