3-cyano-2-(3,4-dimethoxyphenyl)-1-(3-methoxybenzoyl)-7-methyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Chemical Structure Depiction of
3-cyano-2-(3,4-dimethoxyphenyl)-1-(3-methoxybenzoyl)-7-methyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
3-cyano-2-(3,4-dimethoxyphenyl)-1-(3-methoxybenzoyl)-7-methyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8018-2836 |
| Compound Name: | 3-cyano-2-(3,4-dimethoxyphenyl)-1-(3-methoxybenzoyl)-7-methyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide |
| Molecular Weight: | 523.59 |
| Molecular Formula: | C31 H29 N3 O5 |
| Smiles: | Cc1ccc2c(C=CC3C(C#N)(C(C(C(c4cccc(c4)OC)=O)N23)c2ccc(c(c2)OC)OC)C(N)=O)c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2601 |
| logD: | 4.2583 |
| logSw: | -4.6324 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.619 |
| InChI Key: | PXSWFXQSKFUNLG-UHFFFAOYSA-N |