N-(2H-1,3-benzodioxol-5-yl)-2-[8-(4-methoxybenzoyl)-9-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(9H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[8-(4-methoxybenzoyl)-9-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(9H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[8-(4-methoxybenzoyl)-9-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(9H)-yl]acetamide
Compound characteristics
| Compound ID: | C647-0077 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[8-(4-methoxybenzoyl)-9-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(9H)-yl]acetamide |
| Molecular Weight: | 514.49 |
| Molecular Formula: | C28 H22 N2 O8 |
| Smiles: | COc1ccc(cc1)C(C1=CN(CC(Nc2ccc3c(c2)OCO3)=O)c2cc3c(cc2C1=O)OCCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8191 |
| logD: | 2.819 |
| logSw: | -3.5265 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.661 |
| InChI Key: | SOMRDJCNRIHAPQ-UHFFFAOYSA-N |