1-benzoyl-2-(4-ethoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Chemical Structure Depiction of
1-benzoyl-2-(4-ethoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
1-benzoyl-2-(4-ethoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Compound characteristics
| Compound ID: | 8001-1401 |
| Compound Name: | 1-benzoyl-2-(4-ethoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile |
| Molecular Weight: | 445.52 |
| Molecular Formula: | C29 H23 N3 O2 |
| Smiles: | CCOc1ccc(cc1)C1C(C(c2ccccc2)=O)N2C(C=Cc3ccccc23)C1(C#N)C#N |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2529 |
| logD: | 5.1257 |
| logSw: | -5.1521 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 56.935 |
| InChI Key: | INMBJBTYRUWKEK-UHFFFAOYSA-N |