3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1)
Chemical Structure Depiction of
3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1)
3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | E643-1202 |
| Compound Name: | 3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1) |
| Molecular Weight: | 541.91 |
| Molecular Formula: | C21 H14 Cl F4 N3 S |
| Salt: | HOOCCOOH |
| Smiles: | C(c1ccc(cc1[Cl])F)n1c(nc2cccnc12)SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.4251 |
| logD: | 6.4243 |
| logSw: | -6.7909 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.384 |
| InChI Key: | OWAYHKPLRJGYFO-UHFFFAOYSA-N |