3-benzoyl-7-iodo-2-phenyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-1,3-dicarbonitrile
Chemical Structure Depiction of
3-benzoyl-7-iodo-2-phenyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-1,3-dicarbonitrile
3-benzoyl-7-iodo-2-phenyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-1,3-dicarbonitrile
Compound characteristics
| Compound ID: | 8001-7299 |
| Compound Name: | 3-benzoyl-7-iodo-2-phenyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-1,3-dicarbonitrile |
| Molecular Weight: | 527.36 |
| Molecular Formula: | C27 H18 I N3 O |
| Smiles: | C1=Cc2cc(ccc2N2C(C#N)C(c3ccccc3)C(C#N)(C12)C(c1ccccc1)=O)I |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.4655 |
| logD: | 6.4654 |
| logSw: | -6.1156 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 49.764 |
| InChI Key: | WMKOBBDOOLIQTJ-UHFFFAOYSA-N |