4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V010-9209 |
| Compound Name: | 4-(3,4-dichlorophenyl)-3-(4-methoxyphenyl)-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole |
| Molecular Weight: | 456.39 |
| Molecular Formula: | C23 H19 Cl2 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1cccc(CSc2nnc(c3ccc(cc3)OC)n2c2ccc(c(c2)[Cl])[Cl])c1 |
| Stereo: | ACHIRAL |
| logP: | 7.3268 |
| logD: | 7.3268 |
| logSw: | -6.6677 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | VSTBTRICHNKPHW-UHFFFAOYSA-N |