4-(5-{[(3,4-difluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
Chemical Structure Depiction of
4-(5-{[(3,4-difluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
4-(5-{[(3,4-difluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-2-phenylquinoline
Compound characteristics
| Compound ID: | V003-4811 |
| Compound Name: | 4-(5-{[(3,4-difluorophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-2-phenylquinoline |
| Molecular Weight: | 458.53 |
| Molecular Formula: | C26 H20 F2 N4 S |
| Salt: | not_available |
| Smiles: | CCn1c(c2cc(c3ccccc3)nc3ccccc23)nnc1SCc1ccc(c(c1)F)F |
| Stereo: | ACHIRAL |
| logP: | 6.8694 |
| logD: | 6.8685 |
| logSw: | -6.2423 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.025 |
| InChI Key: | MKWDINFWXWWWLK-UHFFFAOYSA-N |