methyl 4-{2-[(3H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[(3H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetamido}benzoate
methyl 4-{2-[(3H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | C797-1610 |
| Compound Name: | methyl 4-{2-[(3H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 342.37 |
| Molecular Formula: | C16 H14 N4 O3 S |
| Smiles: | COC(c1ccc(cc1)NC(CSc1nc2cccnc2[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0656 |
| logD: | 2.058 |
| logSw: | -2.4284 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.677 |
| InChI Key: | WREGRZRXJLSVJV-UHFFFAOYSA-N |