N-[(3,4-dimethoxyphenyl)methyl]-4-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)butanamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-4-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)butanamide
N-[(3,4-dimethoxyphenyl)methyl]-4-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)butanamide
Compound characteristics
| Compound ID: | E854-2857 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-4-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)butanamide |
| Molecular Weight: | 475.55 |
| Molecular Formula: | C26 H29 N5 O4 |
| Smiles: | CC1c2c(C(N(CCCC(NCc3ccc(c(c3)OC)OC)=O)N=1)=O)nn(c1ccccc1)c2C |
| Stereo: | ACHIRAL |
| logP: | 1.9324 |
| logD: | 1.9321 |
| logSw: | -2.5308 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.053 |
| InChI Key: | XUZGNAFNBORFAZ-UHFFFAOYSA-N |