1-benzoyl-3-cyano-7-fluoro-2-(4-methoxyphenyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Chemical Structure Depiction of
1-benzoyl-3-cyano-7-fluoro-2-(4-methoxyphenyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
1-benzoyl-3-cyano-7-fluoro-2-(4-methoxyphenyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8018-4752 |
| Compound Name: | 1-benzoyl-3-cyano-7-fluoro-2-(4-methoxyphenyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide |
| Molecular Weight: | 467.5 |
| Molecular Formula: | C28 H22 F N3 O3 |
| Smiles: | COc1ccc(cc1)C1C(C(c2ccccc2)=O)N2C(C=Cc3cc(ccc23)F)C1(C#N)C(N)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0363 |
| logD: | 4.0319 |
| logSw: | -4.3894 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.358 |
| InChI Key: | ZVBQIKHCYDSCCN-UHFFFAOYSA-N |