1-(2-ethylpiperidin-1-yl)-2-(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)ethan-1-one--oxalic acid (1/1)
Chemical Structure Depiction of
1-(2-ethylpiperidin-1-yl)-2-(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)ethan-1-one--oxalic acid (1/1)
1-(2-ethylpiperidin-1-yl)-2-(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)ethan-1-one--oxalic acid (1/1)
Compound characteristics
| Compound ID: | E643-0315 |
| Compound Name: | 1-(2-ethylpiperidin-1-yl)-2-(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)ethan-1-one--oxalic acid (1/1) |
| Molecular Weight: | 498.6 |
| Molecular Formula: | C23 H28 N4 O S |
| Salt: | HOOCCOOH |
| Smiles: | CCC1CCCCN1C(Cn1c(nc2cccnc12)SCc1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2366 |
| logD: | 4.2353 |
| logSw: | -4.0063 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.423 |
| InChI Key: | NFQBIBPBJJKMNN-IBGZPJMESA-N |