7-(3,4-dimethoxyphenyl)-1-(3-fluorophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
7-(3,4-dimethoxyphenyl)-1-(3-fluorophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
7-(3,4-dimethoxyphenyl)-1-(3-fluorophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | F454-0205 |
| Compound Name: | 7-(3,4-dimethoxyphenyl)-1-(3-fluorophenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 418.42 |
| Molecular Formula: | C24 H19 F N2 O4 |
| Smiles: | COc1ccc(cc1OC)C1CC2=C(C=C(C#N)C(N2c2cccc(c2)F)=O)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.946 |
| logD: | 2.946 |
| logSw: | -3.0903 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.625 |
| InChI Key: | XXVUVVYKEJXULO-OAHLLOKOSA-N |