methyl 2-(6-chloro-7-methoxy-2-oxo-2H-1-benzopyran-4-yl)-4-(3-methoxyphenyl)-4-oxobutanoate
Chemical Structure Depiction of
methyl 2-(6-chloro-7-methoxy-2-oxo-2H-1-benzopyran-4-yl)-4-(3-methoxyphenyl)-4-oxobutanoate
methyl 2-(6-chloro-7-methoxy-2-oxo-2H-1-benzopyran-4-yl)-4-(3-methoxyphenyl)-4-oxobutanoate
Compound characteristics
| Compound ID: | Y040-4810 |
| Compound Name: | methyl 2-(6-chloro-7-methoxy-2-oxo-2H-1-benzopyran-4-yl)-4-(3-methoxyphenyl)-4-oxobutanoate |
| Molecular Weight: | 430.84 |
| Molecular Formula: | C22 H19 Cl O7 |
| Smiles: | COC(C(CC(c1cccc(c1)OC)=O)C1=CC(=O)Oc2cc(c(cc12)[Cl])OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1585 |
| logD: | 4.1585 |
| logSw: | -4.6548 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 69.969 |
| InChI Key: | DOVMPEAQJDNNEP-MRXNPFEDSA-N |