N-(3-chloro-4-methoxyphenyl)-2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamide
N-(3-chloro-4-methoxyphenyl)-2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamide
Compound characteristics
| Compound ID: | G740-1262 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)butanamide |
| Molecular Weight: | 465.94 |
| Molecular Formula: | C24 H24 Cl N5 O3 |
| Smiles: | CCC(C(Nc1ccc(c(c1)[Cl])OC)=O)N1C(c2c(C(C)=N1)nn(c1ccccc1)c2C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3202 |
| logD: | 4.3198 |
| logSw: | -4.7867 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.453 |
| InChI Key: | BRIHCKNCQMDVHN-IBGZPJMESA-N |