3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate
Chemical Structure Depiction of
3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate
3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate
Compound characteristics
| Compound ID: | Y040-2026 |
| Compound Name: | 3-benzyl-4-methyl-2-oxo-2H-1-benzopyran-7-yl 4-methoxybenzoate |
| Molecular Weight: | 400.43 |
| Molecular Formula: | C25 H20 O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(ccc12)OC(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0108 |
| logD: | 5.0108 |
| logSw: | -4.8716 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.81 |
| InChI Key: | HUZZMKCNTGBNSF-UHFFFAOYSA-N |