dimethyl 5-[(6-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(6-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(6-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | K219-0965 |
| Compound Name: | dimethyl 5-[(6-methoxy-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 411.37 |
| Molecular Formula: | C21 H17 N O8 |
| Smiles: | COC(c1cc(cc(c1)NC(C1=Cc2cc(ccc2OC1=O)OC)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3712 |
| logD: | 3.3524 |
| logSw: | -3.674 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.143 |
| InChI Key: | GCKKVAWADZPOAA-UHFFFAOYSA-N |