N-[(3-fluorophenyl)methyl]-4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide--oxalic acid (1/1)
Chemical Structure Depiction of
N-[(3-fluorophenyl)methyl]-4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide--oxalic acid (1/1)
N-[(3-fluorophenyl)methyl]-4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide--oxalic acid (1/1)
Compound characteristics
| Compound ID: | C797-0878 |
| Compound Name: | N-[(3-fluorophenyl)methyl]-4-[({3-[(2-fluorophenyl)methyl]-3H-imidazo[4,5-c]pyridin-2-yl}sulfanyl)methyl]benzamide--oxalic acid (1/1) |
| Molecular Weight: | 590.6 |
| Molecular Formula: | C28 H22 F2 N4 O S |
| Salt: | HOOCCOOH |
| Smiles: | C(c1cccc(c1)F)NC(c1ccc(CSc2nc3ccncc3n2Cc2ccccc2F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5029 |
| logD: | 5.5009 |
| logSw: | -5.7426 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.409 |
| InChI Key: | XUUAQUXCYQZBSN-UHFFFAOYSA-N |