5-[(3-chlorophenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)-6-methyl-1H-pyrazolo[3,4-b]pyridine-3,4(2H,7H)-dione
Chemical Structure Depiction of
5-[(3-chlorophenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)-6-methyl-1H-pyrazolo[3,4-b]pyridine-3,4(2H,7H)-dione
5-[(3-chlorophenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)-6-methyl-1H-pyrazolo[3,4-b]pyridine-3,4(2H,7H)-dione
Compound characteristics
| Compound ID: | 8019-0460 |
| Compound Name: | 5-[(3-chlorophenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)-6-methyl-1H-pyrazolo[3,4-b]pyridine-3,4(2H,7H)-dione |
| Molecular Weight: | 395.85 |
| Molecular Formula: | C20 H18 Cl N5 O2 |
| Smiles: | CC1=C(Cc2cccc(c2)[Cl])C(C2=C(N1)NN(C2=O)c1nc(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9544 |
| logD: | 1.6563 |
| logSw: | -3.569 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.778 |
| InChI Key: | YMLUCFALOHMVAZ-UHFFFAOYSA-N |