ethyl 4-{[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]amino}benzoate
ethyl 4-{[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | E568-0085 |
| Compound Name: | ethyl 4-{[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 428.49 |
| Molecular Formula: | C25 H24 N4 O3 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1cc(C)nc2c1c(C)nn2c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9184 |
| logD: | 4.9141 |
| logSw: | -4.702 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.285 |
| InChI Key: | IPKMIKZBTMBEIK-UHFFFAOYSA-N |