4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[(4-ethoxyphenyl)methyl]butanamide
Chemical Structure Depiction of
4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[(4-ethoxyphenyl)methyl]butanamide
4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[(4-ethoxyphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | E854-6531 |
| Compound Name: | 4-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-[(4-ethoxyphenyl)methyl]butanamide |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C27 H31 N5 O3 |
| Smiles: | CCOc1ccc(CNC(CCCN2C(c3c(C(C)=N2)c(C)n(c2ccc(C)cc2)n3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2314 |
| logD: | 3.2311 |
| logSw: | -3.4103 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.916 |
| InChI Key: | HRABQUZHNFLJEK-UHFFFAOYSA-N |