methyl 4-({[3-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({[3-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)benzoate
methyl 4-({[3-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)benzoate
Compound characteristics
| Compound ID: | Y040-3484 |
| Compound Name: | methyl 4-({[3-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}methyl)benzoate |
| Molecular Weight: | 446.46 |
| Molecular Formula: | C26 H22 O7 |
| Smiles: | COC(c1ccc(COc2ccc3C=C(C(=O)Oc3c2)c2ccc(c(c2)OC)OC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5344 |
| logD: | 4.5344 |
| logSw: | -4.7368 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.551 |
| InChI Key: | KUKRZLFOLDWBPV-UHFFFAOYSA-N |