3-(2-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
3-(2-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
3-(2-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | 3931-2113 |
| Compound Name: | 3-(2-chlorophenyl)-4-oxo-4H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 466.87 |
| Molecular Formula: | C25 H19 Cl O7 |
| Smiles: | COc1cc(cc(c1OC)OC)C(=O)Oc1ccc2C(C(=COc2c1)c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0528 |
| logD: | 4.0528 |
| logSw: | -4.4426 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.216 |
| InChI Key: | BKQMZIQCWPHVFB-UHFFFAOYSA-N |