7-(2-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Chemical Structure Depiction of
7-(2-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
7-(2-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Compound characteristics
Compound ID: | C276-1638 |
Compound Name: | 7-(2-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione |
Molecular Weight: | 456.88 |
Molecular Formula: | C23 H21 Cl N2 O6 |
Smiles: | CCOc1cc(cc(c1O)[N+]([O-])=O)C1CC(NC2CC(CC(C1=2)=O)c1ccccc1[Cl])=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.2931 |
logD: | 3.0297 |
logSw: | -4.4283 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 93.505 |
InChI Key: | ASWADGFAXYRXSJ-UHFFFAOYSA-N |