ethyl 3-[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
ethyl 3-[4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamido]benzoate
ethyl 3-[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: | C890-0864 |
| Compound Name: | ethyl 3-[4-(5,7-dimethyl-1-oxo-2-phenyl-1,2-dihydro-6H-pyrrolo[3,4-d]pyridazin-6-yl)butanamido]benzoate |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C27 H28 N4 O4 |
| Smiles: | CCOC(c1cccc(c1)NC(CCCn1c(C)c2C=NN(C(c2c1C)=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.537 |
| logD: | 3.5344 |
| logSw: | -3.8693 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.39 |
| InChI Key: | FFQXEHWXGGKWFE-UHFFFAOYSA-N |