2-[7-methyl-4-oxo-2-phenyl-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(3-phenylpropyl)acetamide
Chemical Structure Depiction of
2-[7-methyl-4-oxo-2-phenyl-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(3-phenylpropyl)acetamide
2-[7-methyl-4-oxo-2-phenyl-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(3-phenylpropyl)acetamide
Compound characteristics
| Compound ID: | G598-0080 |
| Compound Name: | 2-[7-methyl-4-oxo-2-phenyl-3-(1H-pyrrol-1-yl)-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-(3-phenylpropyl)acetamide |
| Molecular Weight: | 466.54 |
| Molecular Formula: | C27 H26 N6 O2 |
| Smiles: | CC1c2c(C(N(CC(NCCCc3ccccc3)=O)N=1)=O)c(n1cccc1)n(c1ccccc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.1513 |
| logD: | 4.1513 |
| logSw: | -4.3436 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.447 |
| InChI Key: | ZQQNCANLQKKQQC-UHFFFAOYSA-N |