3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazole
3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-1434 |
| Compound Name: | 3-{[(4-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 381.88 |
| Molecular Formula: | C20 H16 Cl N3 O S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1n1c(c2ccco2)nnc1SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0153 |
| logD: | 5.0152 |
| logSw: | -5.0655 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.99 |
| InChI Key: | BDIZHMPLVXRFBF-UHFFFAOYSA-N |