4-(4-ethyl-5-{[(2,3,5,6-tetrafluoro-4-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
Chemical Structure Depiction of
4-(4-ethyl-5-{[(2,3,5,6-tetrafluoro-4-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
4-(4-ethyl-5-{[(2,3,5,6-tetrafluoro-4-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
Compound characteristics
Compound ID: | V005-6449 |
Compound Name: | 4-(4-ethyl-5-{[(2,3,5,6-tetrafluoro-4-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)-2-phenylquinoline |
Molecular Weight: | 508.54 |
Molecular Formula: | C27 H20 F4 N4 S |
Smiles: | CCn1c(c2cc(c3ccccc3)nc3ccccc23)nnc1SCc1c(c(c(C)c(c1F)F)F)F |
Stereo: | ACHIRAL |
logP: | 8.1631 |
logD: | 8.1621 |
logSw: | -6.2164 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 32.025 |
InChI Key: | RUOVNMBYMHBRHY-UHFFFAOYSA-N |