dimethyl 2-[(6-chloro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[(6-chloro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzene-1,4-dicarboxylate
dimethyl 2-[(6-chloro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | K219-0993 |
| Compound Name: | dimethyl 2-[(6-chloro-2-oxo-2H-1-benzopyran-3-carbonyl)amino]benzene-1,4-dicarboxylate |
| Molecular Weight: | 415.79 |
| Molecular Formula: | C20 H14 Cl N O7 |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(C1=Cc2cc(ccc2OC1=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5026 |
| logD: | 1.5208 |
| logSw: | -3.9736 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.901 |
| InChI Key: | RPBYZYXONZKHKT-UHFFFAOYSA-N |