3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazole
3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-1481 |
| Compound Name: | 3-{[(2,4-dichlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 416.33 |
| Molecular Formula: | C20 H15 Cl2 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(c2ccco2)nnc1SCc1ccc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.2151 |
| logD: | 6.215 |
| logSw: | -6.2278 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.291 |
| InChI Key: | QBXGYKAQYVACJD-UHFFFAOYSA-N |