3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(4-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(4-methylphenyl)-4H-1,2,4-triazole
3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(4-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
Compound ID: | V011-5620 |
Compound Name: | 3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(4-methylphenyl)-4H-1,2,4-triazole |
Molecular Weight: | 416.33 |
Molecular Formula: | C20 H15 Cl2 N3 O S |
Salt: | not_available |
Smiles: | Cc1ccc(cc1)n1c(c2ccco2)nnc1SCc1ccc(cc1[Cl])[Cl] |
Stereo: | ACHIRAL |
logP: | 6.1708 |
logD: | 6.1707 |
logSw: | -6.2071 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 33.291 |
InChI Key: | DDHPQUNSOLVTKN-UHFFFAOYSA-N |