3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl 2H-1,3-benzodioxole-5-carboxylate
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl 2H-1,3-benzodioxole-5-carboxylate
3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl 2H-1,3-benzodioxole-5-carboxylate
Compound characteristics
| Compound ID: | G856-6349 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl 2H-1,3-benzodioxole-5-carboxylate |
| Molecular Weight: | 460.44 |
| Molecular Formula: | C26 H20 O8 |
| Smiles: | CC1=C(C(=O)Oc2ccc(cc12)OC(c1ccc2c(c1)OCO2)=O)c1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.3353 |
| logD: | 4.3353 |
| logSw: | -4.4745 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.643 |
| InChI Key: | LZKZGYHXGUNXED-UHFFFAOYSA-N |