3-[(4-chlorophenyl)methyl]-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazole
3-[(4-chlorophenyl)methyl]-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y207-4222 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazole |
| Molecular Weight: | 412.77 |
| Molecular Formula: | C18 H16 Cl3 N3 S |
| Smiles: | CCn1c(Cc2ccc(cc2)[Cl])nnc1SCc1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9762 |
| logD: | 5.9762 |
| logSw: | -6.3873 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.9417 |
| InChI Key: | QYLJDDCVWQVIDK-UHFFFAOYSA-N |