methyl 2-(6-chloro-7-methoxy-2-oxo-2H-1-benzopyran-4-yl)-4-oxo-4-phenylbutanoate
Chemical Structure Depiction of
methyl 2-(6-chloro-7-methoxy-2-oxo-2H-1-benzopyran-4-yl)-4-oxo-4-phenylbutanoate
methyl 2-(6-chloro-7-methoxy-2-oxo-2H-1-benzopyran-4-yl)-4-oxo-4-phenylbutanoate
Compound characteristics
| Compound ID: | Y040-4837 |
| Compound Name: | methyl 2-(6-chloro-7-methoxy-2-oxo-2H-1-benzopyran-4-yl)-4-oxo-4-phenylbutanoate |
| Molecular Weight: | 400.81 |
| Molecular Formula: | C21 H17 Cl O6 |
| Smiles: | COC(C(CC(c1ccccc1)=O)C1=CC(=O)Oc2cc(c(cc12)[Cl])OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7562 |
| logD: | 3.7562 |
| logSw: | -4.2724 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.425 |
| InChI Key: | WPOMPZOVFTWJJL-OAHLLOKOSA-N |