4-[4-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
Chemical Structure Depiction of
4-[4-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
4-[4-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline
Compound characteristics
| Compound ID: | V008-6833 |
| Compound Name: | 4-[4-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2-phenylquinoline |
| Molecular Weight: | 490.55 |
| Molecular Formula: | C27 H21 F3 N4 S |
| Salt: | not_available |
| Smiles: | CCn1c(c2cc(c3ccccc3)nc3ccccc23)nnc1SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 7.4008 |
| logD: | 7.3998 |
| logSw: | -6.331 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.025 |
| InChI Key: | HWFCBWQVISSSRJ-UHFFFAOYSA-N |