4-(5-chloro-2-methylphenyl)-3-{[(3,4-difluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
4-(5-chloro-2-methylphenyl)-3-{[(3,4-difluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4H-1,2,4-triazole
4-(5-chloro-2-methylphenyl)-3-{[(3,4-difluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-3503 |
| Compound Name: | 4-(5-chloro-2-methylphenyl)-3-{[(3,4-difluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 417.86 |
| Molecular Formula: | C20 H14 Cl F2 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1n1c(c2ccco2)nnc1SCc1ccc(c(c1)F)F)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.6222 |
| logD: | 5.6221 |
| logSw: | -5.9329 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.99 |
| InChI Key: | UJVKGWJNDFVRGH-UHFFFAOYSA-N |