4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-N-(propan-2-yl)benzamide--oxalic acid (1/1)
Chemical Structure Depiction of
4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-N-(propan-2-yl)benzamide--oxalic acid (1/1)
4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-N-(propan-2-yl)benzamide--oxalic acid (1/1)
Compound characteristics
| Compound ID: | E642-1314 |
| Compound Name: | 4-[(2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-N-(propan-2-yl)benzamide--oxalic acid (1/1) |
| Molecular Weight: | 520.61 |
| Molecular Formula: | C25 H26 N4 O S |
| Salt: | HOOCCOOH |
| Smiles: | CC(C)NC(c1ccc(Cn2c(nc3cccnc23)SCc2cccc(C)c2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1034 |
| logD: | 5.1025 |
| logSw: | -4.8233 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.043 |
| InChI Key: | MKDVDFCQELNEAX-UHFFFAOYSA-N |