2-{[(3-fluorophenyl)methyl]sulfanyl}-3-[(2-methylphenyl)methyl]-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1)
Chemical Structure Depiction of
2-{[(3-fluorophenyl)methyl]sulfanyl}-3-[(2-methylphenyl)methyl]-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1)
2-{[(3-fluorophenyl)methyl]sulfanyl}-3-[(2-methylphenyl)methyl]-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | E643-0788 |
| Compound Name: | 2-{[(3-fluorophenyl)methyl]sulfanyl}-3-[(2-methylphenyl)methyl]-3H-imidazo[4,5-b]pyridine--oxalic acid (1/1) |
| Molecular Weight: | 453.49 |
| Molecular Formula: | C21 H18 F N3 S |
| Salt: | HOOCCOOH |
| Smiles: | Cc1ccccc1Cn1c(nc2cccnc12)SCc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.6843 |
| logD: | 5.6797 |
| logSw: | -5.6507 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.384 |
| InChI Key: | XTRSYTOYTCIDPS-UHFFFAOYSA-N |