6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | Y040-0993 |
| Compound Name: | 6-chloro-2-oxo-4-phenyl-2H-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)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3173 |
| logD: | 4.3173 |
| logSw: | -4.771 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.817 |
| InChI Key: | HQFOJTLPLQQIPM-UHFFFAOYSA-N |