diethyl 2-amino-1-(2-methyl-5-nitrophenyl)-5-oxo-4-(pyridin-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Chemical Structure Depiction of
diethyl 2-amino-1-(2-methyl-5-nitrophenyl)-5-oxo-4-(pyridin-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
diethyl 2-amino-1-(2-methyl-5-nitrophenyl)-5-oxo-4-(pyridin-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | 8016-4653 |
| Compound Name: | diethyl 2-amino-1-(2-methyl-5-nitrophenyl)-5-oxo-4-(pyridin-3-yl)-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate |
| Molecular Weight: | 602.67 |
| Molecular Formula: | C31 H30 N4 O7 S |
| Smiles: | CCOC(C1C(CC2=C(C(C(=C(N)N2c2cc(ccc2C)[N+]([O-])=O)C(=O)OCC)c2cccnc2)C1=O)c1cccs1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4102 |
| logD: | 4.4101 |
| logSw: | -4.4361 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 120.072 |
| InChI Key: | KMDBGTVUTBBXCC-UHFFFAOYSA-N |