3-(4-chlorophenyl)-2-oxo-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
3-(4-chlorophenyl)-2-oxo-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
3-(4-chlorophenyl)-2-oxo-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | Y040-3460 |
| Compound Name: | 3-(4-chlorophenyl)-2-oxo-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)Oc1ccc2C=C(C(=O)Oc2c1)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4721 |
| logD: | 4.4721 |
| logSw: | -4.7279 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.244 |
| InChI Key: | NBOKIAGQTSUKGF-UHFFFAOYSA-N |