2-[2-(3-fluorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(4-phenylbutan-2-yl)acetamide
Chemical Structure Depiction of
2-[2-(3-fluorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(4-phenylbutan-2-yl)acetamide
2-[2-(3-fluorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(4-phenylbutan-2-yl)acetamide
Compound characteristics
| Compound ID: | G598-2824 |
| Compound Name: | 2-[2-(3-fluorophenyl)-7-methyl-4-oxo-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(4-phenylbutan-2-yl)acetamide |
| Molecular Weight: | 498.56 |
| Molecular Formula: | C28 H27 F N6 O2 |
| Smiles: | CC(CCc1ccccc1)NC(CN1C(c2c(C(C)=N1)nn(c1cccc(c1)F)c2n1cccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.543 |
| logD: | 4.543 |
| logSw: | -4.5069 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.047 |
| InChI Key: | XMWFQFDUJPPBKR-IBGZPJMESA-N |