3-{[(4-chlorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(4-chlorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole
3-{[(4-chlorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V010-9299 |
| Compound Name: | 3-{[(4-chlorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazole |
| Molecular Weight: | 436.74 |
| Molecular Formula: | C19 H12 Cl3 N3 O S |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)[Cl])Sc1nnc(c2ccco2)n1c1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9645 |
| logD: | 5.9645 |
| logSw: | -6.4176 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.291 |
| InChI Key: | JXRDUGCHQPFSKD-UHFFFAOYSA-N |