4-(4-methoxyphenyl)-5-nitro-1-(propan-2-yl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-3,6(2H,5H)-dione
Chemical Structure Depiction of
4-(4-methoxyphenyl)-5-nitro-1-(propan-2-yl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-3,6(2H,5H)-dione
4-(4-methoxyphenyl)-5-nitro-1-(propan-2-yl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-3,6(2H,5H)-dione
Compound characteristics
| Compound ID: | 8020-7196 |
| Compound Name: | 4-(4-methoxyphenyl)-5-nitro-1-(propan-2-yl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-3,6(2H,5H)-dione |
| Molecular Weight: | 346.34 |
| Molecular Formula: | C16 H18 N4 O5 |
| Smiles: | CC(C)N1C2=C(C(C(C(N2)=O)[N+]([O-])=O)c2ccc(cc2)OC)C(N1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.7715 |
| logD: | -3.5813 |
| logSw: | -1.9286 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.669 |
| InChI Key: | IBUPEPKKIMRERW-UHFFFAOYSA-N |