4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
Compound ID: | V010-9140 |
Compound Name: | 4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole |
Molecular Weight: | 456.39 |
Molecular Formula: | C23 H19 Cl2 N3 O S |
Salt: | not_available |
Smiles: | Cc1ccccc1CSc1nnc(c2ccc(cc2)OC)n1c1ccc(c(c1)[Cl])[Cl] |
Stereo: | ACHIRAL |
logP: | 7.4804 |
logD: | 7.4804 |
logSw: | -6.6185 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 32.256 |
InChI Key: | NSWRDDQIQBCEKU-UHFFFAOYSA-N |