4-[4-(2-methoxyethyl)-5-{[(2,3,6-trifluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
Chemical Structure Depiction of
4-[4-(2-methoxyethyl)-5-{[(2,3,6-trifluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
4-[4-(2-methoxyethyl)-5-{[(2,3,6-trifluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
Compound characteristics
| Compound ID: | V005-6941 |
| Compound Name: | 4-[4-(2-methoxyethyl)-5-{[(2,3,6-trifluorophenyl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl]-2-phenylquinoline |
| Molecular Weight: | 506.55 |
| Molecular Formula: | C27 H21 F3 N4 O S |
| Salt: | not_available |
| Smiles: | COCCn1c(c2cc(c3ccccc3)nc3ccccc23)nnc1SCc1c(ccc(c1F)F)F |
| Stereo: | ACHIRAL |
| logP: | 6.8123 |
| logD: | 6.8114 |
| logSw: | -6.1042 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.621 |
| InChI Key: | HNRCNBSUWIKINU-UHFFFAOYSA-N |