ethyl 1-{4-[7-methyl-4-oxo-2-phenyl-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]butanoyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[7-methyl-4-oxo-2-phenyl-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]butanoyl}piperidine-3-carboxylate
ethyl 1-{4-[7-methyl-4-oxo-2-phenyl-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]butanoyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | F747-0465 |
| Compound Name: | ethyl 1-{4-[7-methyl-4-oxo-2-phenyl-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]butanoyl}piperidine-3-carboxylate |
| Molecular Weight: | 516.6 |
| Molecular Formula: | C28 H32 N6 O4 |
| Smiles: | CCOC(C1CCCN(C1)C(CCCN1C(c2c(C(C)=N1)nn(c1ccccc1)c2n1cccc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9609 |
| logD: | 2.9609 |
| logSw: | -3.0718 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.192 |
| InChI Key: | KZSHNOTVUCPHIJ-NRFANRHFSA-N |