3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-methyl-4H-1,2,4-triazole
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6618 |
| Compound Name: | 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 323.77 |
| Molecular Formula: | C14 H11 Cl F N3 O S |
| Smiles: | Cn1c(c2ccco2)nnc1SCc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 3.5155 |
| logD: | 3.5155 |
| logSw: | -3.7967 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.629 |
| InChI Key: | NMTDDTNJXNBLNR-UHFFFAOYSA-N |