3-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate
3-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y042-9166 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate |
| Molecular Weight: | 408.43 |
| Molecular Formula: | C22 H16 O6 S |
| Smiles: | COc1ccc(cc1OC)C1=Cc2ccc(cc2OC1=O)OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9946 |
| logD: | 3.9946 |
| logSw: | -4.36 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.546 |
| InChI Key: | STLAPPHUJWEDQH-UHFFFAOYSA-N |