3-cyano-1-(4-methylbenzoyl)-2-(pyridin-3-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Chemical Structure Depiction of
3-cyano-1-(4-methylbenzoyl)-2-(pyridin-3-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
3-cyano-1-(4-methylbenzoyl)-2-(pyridin-3-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8018-4746 |
| Compound Name: | 3-cyano-1-(4-methylbenzoyl)-2-(pyridin-3-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide |
| Molecular Weight: | 434.5 |
| Molecular Formula: | C27 H22 N4 O2 |
| Smiles: | Cc1ccc(cc1)C(C1C(c2cccnc2)C(C#N)(C2C=Cc3ccccc3N12)C(N)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2476 |
| logD: | 3.2464 |
| logSw: | -3.2752 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.332 |
| InChI Key: | ZKCIZRUNBYAAHG-UHFFFAOYSA-N |