7-bromo-3-cyano-1-(2,2-dimethylpropanoyl)-2-(pyridin-4-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Chemical Structure Depiction of
7-bromo-3-cyano-1-(2,2-dimethylpropanoyl)-2-(pyridin-4-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
7-bromo-3-cyano-1-(2,2-dimethylpropanoyl)-2-(pyridin-4-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8018-4740 |
| Compound Name: | 7-bromo-3-cyano-1-(2,2-dimethylpropanoyl)-2-(pyridin-4-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide |
| Molecular Weight: | 479.38 |
| Molecular Formula: | C24 H23 Br N4 O2 |
| Smiles: | CC(C)(C)C(C1C(c2ccncc2)C(C#N)(C2C=Cc3cc(ccc3N12)[Br])C(N)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5323 |
| logD: | 3.522 |
| logSw: | -3.703 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.514 |
| InChI Key: | QZKMTHADUPLENL-UHFFFAOYSA-N |