3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | Y040-1982 |
| Compound Name: | 3-benzyl-4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 474.51 |
| Molecular Formula: | C28 H26 O7 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OC(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0555 |
| logD: | 5.0555 |
| logSw: | -4.8988 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.015 |
| InChI Key: | SHYGSEFLFMMYRC-UHFFFAOYSA-N |