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-(propylsulfanyl)propyl]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-(propylsulfanyl)propyl]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-(propylsulfanyl)propyl]acetamide
Compound characteristics
| Compound ID: | G598-0201 |
| 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-(propylsulfanyl)propyl]acetamide |
| Molecular Weight: | 464.59 |
| Molecular Formula: | C24 H28 N6 O2 S |
| Smiles: | CCCSCCCNC(CN1C(c2c(C(C)=N1)nn(c1ccccc1)c2n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1494 |
| logD: | 3.1494 |
| logSw: | -3.2582 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.718 |
| InChI Key: | HFSRSNALBQDNFG-UHFFFAOYSA-N |