4-[5-{[(2,6-difluorophenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-6,7-dimethyl-2-(thiophen-2-yl)quinoline
Chemical Structure Depiction of
4-[5-{[(2,6-difluorophenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-6,7-dimethyl-2-(thiophen-2-yl)quinoline
4-[5-{[(2,6-difluorophenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-6,7-dimethyl-2-(thiophen-2-yl)quinoline
Compound characteristics
Compound ID: | V003-4774 |
Compound Name: | 4-[5-{[(2,6-difluorophenyl)methyl]sulfanyl}-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]-6,7-dimethyl-2-(thiophen-2-yl)quinoline |
Molecular Weight: | 506.64 |
Molecular Formula: | C27 H24 F2 N4 S2 |
Salt: | not_available |
Smiles: | CC(C)n1c(c2cc(c3cccs3)nc3cc(C)c(C)cc23)nnc1SCc1c(cccc1F)F |
Stereo: | ACHIRAL |
logP: | 8.0353 |
logD: | 8.0353 |
logSw: | -6.1911 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 34.394 |
InChI Key: | WFDWDBODMDTLKL-UHFFFAOYSA-N |