3-[(4-chlorophenyl)methyl]-5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
3-[(4-chlorophenyl)methyl]-5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y207-4204 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 424.78 |
| Molecular Formula: | C19 H16 Cl3 N3 S |
| Smiles: | C=CCn1c(Cc2ccc(cc2)[Cl])nnc1SCc1c(cccc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.1532 |
| logD: | 6.1532 |
| logSw: | -6.4575 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.1953 |
| InChI Key: | BSPJPAQJDFEEPL-UHFFFAOYSA-N |