ethyl 3-[2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamido]benzoate
Chemical Structure Depiction of
ethyl 3-[2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamido]benzoate
ethyl 3-[2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamido]benzoate
Compound characteristics
| Compound ID: | G740-1168 |
| Compound Name: | ethyl 3-[2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamido]benzoate |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C26 H27 N5 O4 |
| Smiles: | CCC(C(Nc1cccc(c1)C(=O)OCC)=O)N1C(c2c(C(C)=N1)nn(c1ccccc1)c2C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5915 |
| logD: | 4.5915 |
| logSw: | -4.4572 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.576 |
| InChI Key: | VISVHOYIGUJKKL-NRFANRHFSA-N |