2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]acetamide--oxalic acid (1/1)
Chemical Structure Depiction of
2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]acetamide--oxalic acid (1/1)
2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]acetamide--oxalic acid (1/1)
Compound characteristics
| Compound ID: | E643-0824 |
| Compound Name: | 2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]acetamide--oxalic acid (1/1) |
| Molecular Weight: | 528.58 |
| Molecular Formula: | C22 H19 F N4 O S2 |
| Salt: | HOOCCOOH |
| Smiles: | CSc1cccc(c1)NC(Cn1c(nc2cccnc12)SCc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9761 |
| logD: | 4.9761 |
| logSw: | -4.6827 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.533 |
| InChI Key: | HFNBNLMNFKNWBQ-UHFFFAOYSA-N |