3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-5399 |
| Compound Name: | 3-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 456.39 |
| Molecular Formula: | C23 H19 Cl2 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)c1nnc(n1c1ccc(cc1)OC)SCc1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.0584 |
| logD: | 7.0584 |
| logSw: | -6.6585 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | ZSEJUGCXQMQPJK-UHFFFAOYSA-N |