4-{5-({[3-fluoro-5-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}-2-phenylquinoline
Chemical Structure Depiction of
4-{5-({[3-fluoro-5-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}-2-phenylquinoline
4-{5-({[3-fluoro-5-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}-2-phenylquinoline
Compound characteristics
| Compound ID: | V011-5879 |
| Compound Name: | 4-{5-({[3-fluoro-5-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}-2-phenylquinoline |
| Molecular Weight: | 560.57 |
| Molecular Formula: | C30 H20 F4 N4 O S |
| Salt: | not_available |
| Smiles: | C(c1ccco1)n1c(c2cc(c3ccccc3)nc3ccccc23)nnc1SCc1cc(cc(c1)F)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 8.22 |
| logD: | 8.2191 |
| logSw: | -6.6556 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.777 |
| InChI Key: | SCQIJJGWMGKTOK-UHFFFAOYSA-N |