1-(4-chlorobenzoyl)-3-cyano-7-fluoro-2-(pyridin-3-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Chemical Structure Depiction of
1-(4-chlorobenzoyl)-3-cyano-7-fluoro-2-(pyridin-3-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
1-(4-chlorobenzoyl)-3-cyano-7-fluoro-2-(pyridin-3-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8018-4751 |
| Compound Name: | 1-(4-chlorobenzoyl)-3-cyano-7-fluoro-2-(pyridin-3-yl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide |
| Molecular Weight: | 472.91 |
| Molecular Formula: | C26 H18 Cl F N4 O2 |
| Smiles: | C1=Cc2cc(ccc2N2C(C(c3cccnc3)C(C#N)(C12)C(N)=O)C(c1ccc(cc1)[Cl])=O)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5953 |
| logD: | 3.5878 |
| logSw: | -4.1522 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.332 |
| InChI Key: | CFAWSNRRDCZTJN-UHFFFAOYSA-N |