6-ethoxy-2-(4-methoxyphenyl)-4-(4-methyl-5-{[(pentafluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)quinoline
Chemical Structure Depiction of
6-ethoxy-2-(4-methoxyphenyl)-4-(4-methyl-5-{[(pentafluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)quinoline
6-ethoxy-2-(4-methoxyphenyl)-4-(4-methyl-5-{[(pentafluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)quinoline
Compound characteristics
| Compound ID: | V011-4991 |
| Compound Name: | 6-ethoxy-2-(4-methoxyphenyl)-4-(4-methyl-5-{[(pentafluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)quinoline |
| Molecular Weight: | 572.56 |
| Molecular Formula: | C28 H21 F5 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCOc1ccc2c(c1)c(cc(c1ccc(cc1)OC)n2)c1nnc(n1C)SCc1c(c(c(c(c1F)F)F)F)F |
| Stereo: | ACHIRAL |
| logP: | 7.6516 |
| logD: | 7.6273 |
| logSw: | -6.0308 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.777 |
| InChI Key: | OXIWVOYHAUWRFX-UHFFFAOYSA-N |