3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazole
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-5834 |
| Compound Name: | 3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 381.88 |
| Molecular Formula: | C20 H16 Cl N3 O S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(c2ccco2)nnc1SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.124 |
| logD: | 5.1239 |
| logSw: | -5.5331 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.291 |
| InChI Key: | GXRNFTBRHRJLNK-UHFFFAOYSA-N |