N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-chlorobenzoyl)-6,7-dimethoxy-4-oxoquinolin-1(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-chlorobenzoyl)-6,7-dimethoxy-4-oxoquinolin-1(4H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-chlorobenzoyl)-6,7-dimethoxy-4-oxoquinolin-1(4H)-yl]acetamide
Compound characteristics
Compound ID: | C647-0064 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-chlorobenzoyl)-6,7-dimethoxy-4-oxoquinolin-1(4H)-yl]acetamide |
Molecular Weight: | 520.93 |
Molecular Formula: | C27 H21 Cl N2 O7 |
Smiles: | COc1cc2C(C(=CN(CC(Nc3ccc4c(c3)OCO4)=O)c2cc1OC)C(c1ccc(cc1)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1937 |
logD: | 4.1937 |
logSw: | -4.5561 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.555 |
InChI Key: | JTFDCJSVIJNJTR-UHFFFAOYSA-N |