4-[({3-[(3-methylphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzoic acid
Chemical Structure Depiction of
4-[({3-[(3-methylphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzoic acid
4-[({3-[(3-methylphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzoic acid
Compound characteristics
| Compound ID: | C797-1344 |
| Compound Name: | 4-[({3-[(3-methylphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzoic acid |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C22 H19 N3 O2 S |
| Smiles: | Cc1cccc(Cn2c(nc3cccnc23)SCc2ccc(cc2)C(O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.0231 |
| logD: | 2.0516 |
| logSw: | -4.4483 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.792 |
| InChI Key: | KJMBGIUTUVRIPQ-UHFFFAOYSA-N |