6-(4-methoxybenzoyl)-2,4-dioxo-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile
Chemical Structure Depiction of
6-(4-methoxybenzoyl)-2,4-dioxo-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile
6-(4-methoxybenzoyl)-2,4-dioxo-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile
Compound characteristics
| Compound ID: | 8020-0563 |
| Compound Name: | 6-(4-methoxybenzoyl)-2,4-dioxo-3-azabicyclo[3.1.0]hexane-1,5-dicarbonitrile |
| Molecular Weight: | 295.25 |
| Molecular Formula: | C15 H9 N3 O4 |
| Smiles: | COc1ccc(cc1)C(C1C2(C#N)C(NC(C12C#N)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.5965 |
| logD: | -0.5682 |
| logSw: | -1.8535 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.65 |
| InChI Key: | DEJKTODKRQGORY-UHFFFAOYSA-N |