3-{[(3-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(3-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-methyl-4H-1,2,4-triazole
3-{[(3-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6615 |
| Compound Name: | 3-{[(3-chlorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 305.78 |
| Molecular Formula: | C14 H12 Cl N3 O S |
| Smiles: | Cn1c(c2ccco2)nnc1SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4219 |
| logD: | 3.4218 |
| logSw: | -3.6443 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.629 |
| InChI Key: | LFJVHRDTTPMBSX-UHFFFAOYSA-N |