6-[4-(difluoromethoxy)phenyl]-3-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
Chemical Structure Depiction of
6-[4-(difluoromethoxy)phenyl]-3-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
6-[4-(difluoromethoxy)phenyl]-3-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
Compound characteristics
| Compound ID: | E455-0440 |
| Compound Name: | 6-[4-(difluoromethoxy)phenyl]-3-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid |
| Molecular Weight: | 426.33 |
| Molecular Formula: | C20 H12 F2 N4 O5 |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)c1c2c(cc(c3ccc(cc3)OC(F)F)nc2n[nH]1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8587 |
| logD: | 0.0695 |
| logSw: | -4.8092 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.279 |
| InChI Key: | MNEYBUYJLNCITF-UHFFFAOYSA-N |