3-{[(3-fluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(3-fluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole
3-{[(3-fluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole
Compound characteristics
Compound ID: | V011-9451 |
Compound Name: | 3-{[(3-fluorophenyl)methyl]sulfanyl}-5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazole |
Molecular Weight: | 381.43 |
Molecular Formula: | C20 H16 F N3 O2 S |
Smiles: | COc1ccccc1n1c(c2ccco2)nnc1SCc1cccc(c1)F |
Stereo: | ACHIRAL |
logP: | 4.2381 |
logD: | 4.2379 |
logSw: | -4.3929 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 40.62 |
InChI Key: | JEDRPCJRYRBRKX-UHFFFAOYSA-N |