3-(3,4-dimethoxyphenyl)-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
3-(3,4-dimethoxyphenyl)-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8020-1134 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-7-hydroxy-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 312.32 |
| Molecular Formula: | C18 H16 O5 |
| Smiles: | CC1=C(C(=O)Oc2cc(ccc12)O)c1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8738 |
| logD: | 2.8445 |
| logSw: | -3.0342 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.766 |
| InChI Key: | AQGVQGLSKSEDGI-UHFFFAOYSA-N |