3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl benzoate
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl benzoate
3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl benzoate
Compound characteristics
| Compound ID: | G856-6286 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl benzoate |
| Molecular Weight: | 416.43 |
| Molecular Formula: | C25 H20 O6 |
| Smiles: | CC1=C(C(=O)Oc2ccc(cc12)OC(c1ccccc1)=O)c1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.428 |
| logD: | 4.428 |
| logSw: | -4.5552 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.527 |
| InChI Key: | ZVZNXUJNFMCNQA-UHFFFAOYSA-N |