2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]butanamide
Chemical Structure Depiction of
2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]butanamide
2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]butanamide
Compound characteristics
| Compound ID: | G740-1313 |
| Compound Name: | 2-(3,7-dimethyl-4-oxo-2-phenyl-2,4-dihydro-5H-pyrazolo[3,4-d]pyridazin-5-yl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]butanamide |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C27 H31 N5 O4 |
| Smiles: | CCC(C(NCc1ccc(c(c1)OC)OCC)=O)N1C(c2c(C(C)=N1)nn(c1ccccc1)c2C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3706 |
| logD: | 3.3706 |
| logSw: | -3.6725 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.986 |
| InChI Key: | BVPLSZKIBFQBLH-NRFANRHFSA-N |