methyl 2-[4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamido]benzoate
Chemical Structure Depiction of
methyl 2-[4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamido]benzoate
methyl 2-[4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamido]benzoate
Compound characteristics
| Compound ID: | C890-0872 |
| Compound Name: | methyl 2-[4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamido]benzoate |
| Molecular Weight: | 458.52 |
| Molecular Formula: | C26 H26 N4 O4 |
| Smiles: | Cc1c2C=NN(C(c2c(C)n1CCCC(Nc1ccccc1C(=O)OC)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4795 |
| logD: | 2.2892 |
| logSw: | -3.0866 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.112 |
| InChI Key: | GOPFBHAIFMHHFE-UHFFFAOYSA-N |