2-amino-4-(2,5-dimethoxyphenyl)-1-(4-fluoro-3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2,5-dimethoxyphenyl)-1-(4-fluoro-3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-4-(2,5-dimethoxyphenyl)-1-(4-fluoro-3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | Y500-6677 |
| Compound Name: | 2-amino-4-(2,5-dimethoxyphenyl)-1-(4-fluoro-3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 464.45 |
| Molecular Formula: | C24 H21 F N4 O5 |
| Smiles: | COc1ccc(c(c1)C1C(C#N)=C(N)N(C2CCCC(C1=2)=O)c1ccc(c(c1)[N+]([O-])=O)F)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3842 |
| logD: | 3.3842 |
| logSw: | -4.0847 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.632 |
| InChI Key: | FSRSWYGUGPQHOQ-QFIPXVFZSA-N |