2-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[2-(2-methoxyphenyl)ethyl]butanamide
Chemical Structure Depiction of
2-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[2-(2-methoxyphenyl)ethyl]butanamide
2-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[2-(2-methoxyphenyl)ethyl]butanamide
Compound characteristics
| Compound ID: | E854-1698 |
| Compound Name: | 2-(3,4-dimethyl-7-oxo-2-phenyl-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl)-N-[2-(2-methoxyphenyl)ethyl]butanamide |
| Molecular Weight: | 459.55 |
| Molecular Formula: | C26 H29 N5 O3 |
| Smiles: | CCC(C(NCCc1ccccc1OC)=O)N1C(c2c(C(C)=N1)c(C)n(c1ccccc1)n2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8695 |
| logD: | 3.8695 |
| logSw: | -4.2651 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.617 |
| InChI Key: | RKQBOEKYGVNTKW-NRFANRHFSA-N |