N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-ethylbenzoyl)-6,7-dimethoxy-4-oxoquinolin-1(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-ethylbenzoyl)-6,7-dimethoxy-4-oxoquinolin-1(4H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-ethylbenzoyl)-6,7-dimethoxy-4-oxoquinolin-1(4H)-yl]acetamide
Compound characteristics
| Compound ID: | C647-0059 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[3-(4-ethylbenzoyl)-6,7-dimethoxy-4-oxoquinolin-1(4H)-yl]acetamide |
| Molecular Weight: | 514.53 |
| Molecular Formula: | C29 H26 N2 O7 |
| Smiles: | CCc1ccc(cc1)C(C1=CN(CC(Nc2ccc3c(c2)OCO3)=O)c2cc(c(cc2C1=O)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5297 |
| logD: | 4.5296 |
| logSw: | -4.3555 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.555 |
| InChI Key: | IVIMJYKGZQNGAI-UHFFFAOYSA-N |