3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V007-7518 |
| Compound Name: | 3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 421.95 |
| Molecular Formula: | C23 H20 Cl N3 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)n1c(c2cccc(c2)OC)nnc1SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.1906 |
| logD: | 6.1906 |
| logSw: | -6.3788 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | KXFQUWOPVJGXAA-UHFFFAOYSA-N |