3-(4-ethylphenyl)-6-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
Chemical Structure Depiction of
3-(4-ethylphenyl)-6-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
3-(4-ethylphenyl)-6-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
Compound characteristics
| Compound ID: | E455-0456 |
| Compound Name: | 3-(4-ethylphenyl)-6-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid |
| Molecular Weight: | 388.38 |
| Molecular Formula: | C21 H16 N4 O4 |
| Smiles: | CCc1ccc(cc1)c1c2c(cc(c3cccc(c3)[N+]([O-])=O)nc2n[nH]1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6062 |
| logD: | 0.817 |
| logSw: | -5.5089 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.674 |
| InChI Key: | WJRMGUXSPDKCCW-UHFFFAOYSA-N |