2-phenyl-4-[4-(prop-2-en-1-yl)-5-{[(2,4,6-trifluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]quinoline
Chemical Structure Depiction of
2-phenyl-4-[4-(prop-2-en-1-yl)-5-{[(2,4,6-trifluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]quinoline
2-phenyl-4-[4-(prop-2-en-1-yl)-5-{[(2,4,6-trifluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]quinoline
Compound characteristics
| Compound ID: | V003-3666 |
| Compound Name: | 2-phenyl-4-[4-(prop-2-en-1-yl)-5-{[(2,4,6-trifluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]quinoline |
| Molecular Weight: | 488.53 |
| Molecular Formula: | C27 H19 F3 N4 S |
| Salt: | not_available |
| Smiles: | C=CCn1c(c2cc(c3ccccc3)nc3ccccc23)nnc1SCc1c(cc(cc1F)F)F |
| Stereo: | ACHIRAL |
| logP: | 7.3848 |
| logD: | 7.3839 |
| logSw: | -6.7657 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.278 |
| InChI Key: | ZNIBOOMAGOXAIY-UHFFFAOYSA-N |