7-hydroxy-2-oxo-4-(3,4,5-trimethoxyphenyl)-2H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
7-hydroxy-2-oxo-4-(3,4,5-trimethoxyphenyl)-2H-1-benzopyran-3-carbonitrile
7-hydroxy-2-oxo-4-(3,4,5-trimethoxyphenyl)-2H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-7970 |
| Compound Name: | 7-hydroxy-2-oxo-4-(3,4,5-trimethoxyphenyl)-2H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 353.33 |
| Molecular Formula: | C19 H15 N O6 |
| Smiles: | COc1cc(cc(c1OC)OC)C1=C(C#N)C(=O)Oc2cc(ccc12)O |
| Stereo: | ACHIRAL |
| logP: | 2.3836 |
| logD: | 2.2383 |
| logSw: | -2.9017 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.54 |
| InChI Key: | GXFRIPBZRDXKOA-UHFFFAOYSA-N |