4-[5-({[2-fluoro-6-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
Chemical Structure Depiction of
4-[5-({[2-fluoro-6-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
4-[5-({[2-fluoro-6-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
Compound characteristics
| Compound ID: | V003-3700 |
| Compound Name: | 4-[5-({[2-fluoro-6-(trifluoromethyl)phenyl]methyl}sulfanyl)-4-(3-methoxypropyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline |
| Molecular Weight: | 552.59 |
| Molecular Formula: | C29 H24 F4 N4 O S |
| Salt: | not_available |
| Smiles: | COCCCn1c(c2cc(c3ccccc3)nc3ccccc23)nnc1SCc1c(cccc1F)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 7.549 |
| logD: | 7.548 |
| logSw: | -6.0772 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.621 |
| InChI Key: | JCELPWGTTKIRHP-UHFFFAOYSA-N |