dimethyl 2-amino-5-oxo-7-phenyl-4-(pyridin-3-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-amino-5-oxo-7-phenyl-4-(pyridin-3-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
dimethyl 2-amino-5-oxo-7-phenyl-4-(pyridin-3-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | 8015-3478 |
| Compound Name: | dimethyl 2-amino-5-oxo-7-phenyl-4-(pyridin-3-yl)-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
| Molecular Weight: | 577.56 |
| Molecular Formula: | C31 H26 F3 N3 O5 |
| Smiles: | COC(C1C(CC2=C(C(C(=C(N)N2c2cccc(c2)C(F)(F)F)C(=O)OC)c2cccnc2)C1=O)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2924 |
| logD: | 4.2917 |
| logSw: | -4.4357 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.813 |
| InChI Key: | CNVPDKUXRXYBOZ-UHFFFAOYSA-N |