3-[(4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1)
Chemical Structure Depiction of
3-[(4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1)
3-[(4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | E643-1146 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1) |
| Molecular Weight: | 507.46 |
| Molecular Formula: | C21 H15 F4 N3 S |
| Salt: | HOOCCOOH |
| Smiles: | C(c1ccc(cc1)F)n1c(nc2cccnc12)SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.5917 |
| logD: | 5.5909 |
| logSw: | -6.2281 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.384 |
| InChI Key: | OWXOORKCSQQZFK-UHFFFAOYSA-N |