methyl 4-({[3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({[3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}methyl)benzoate
methyl 4-({[3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}methyl)benzoate
Compound characteristics
| Compound ID: | G856-6216 |
| Compound Name: | methyl 4-({[3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}methyl)benzoate |
| Molecular Weight: | 460.48 |
| Molecular Formula: | C27 H24 O7 |
| Smiles: | CC1=C(C(=O)Oc2ccc(cc12)OCc1ccc(cc1)C(=O)OC)c1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 5.0247 |
| logD: | 5.0247 |
| logSw: | -4.9742 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.551 |
| InChI Key: | JCMBOZRNQNHUBH-UHFFFAOYSA-N |