N-(2H-1,3-benzodioxol-5-yl)-2-(8-benzoyl-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-benzoyl-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-benzoyl-9-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(9H)-yl)acetamide
Compound characteristics
| Compound ID: | C647-0073 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-(8-benzoyl-9-oxo-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-6(9H)-yl)acetamide |
| Molecular Weight: | 484.46 |
| Molecular Formula: | C27 H20 N2 O7 |
| Smiles: | C(C(Nc1ccc2c(c1)OCO2)=O)N1C=C(C(c2ccccc2)=O)C(c2cc3c(cc12)OCCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7316 |
| logD: | 2.7316 |
| logSw: | -3.603 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.118 |
| InChI Key: | MUSPFEKRQGSMAB-UHFFFAOYSA-N |