1-benzoyl-2-(3,5-dimethoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Chemical Structure Depiction of
1-benzoyl-2-(3,5-dimethoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
1-benzoyl-2-(3,5-dimethoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Compound characteristics
| Compound ID: | 3132-1014 |
| Compound Name: | 1-benzoyl-2-(3,5-dimethoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C29 H23 N3 O3 |
| Smiles: | [H]C12C=Cc3ccccc3N2C(C(c2cc(cc(c2)OC)OC)C1(C#N)C#N)C(c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7662 |
| logD: | 4.6391 |
| logSw: | -4.5891 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 64.899 |
| InChI Key: | URJWJFDCZIKQNF-UHFFFAOYSA-N |