8-[(dimethylamino)methyl]-3-(3,5-dimethylphenoxy)-7-hydroxy-4H-1-benzopyran-4-one
Chemical Structure Depiction of
8-[(dimethylamino)methyl]-3-(3,5-dimethylphenoxy)-7-hydroxy-4H-1-benzopyran-4-one
8-[(dimethylamino)methyl]-3-(3,5-dimethylphenoxy)-7-hydroxy-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 3643-2430 |
| Compound Name: | 8-[(dimethylamino)methyl]-3-(3,5-dimethylphenoxy)-7-hydroxy-4H-1-benzopyran-4-one |
| Molecular Weight: | 339.39 |
| Molecular Formula: | C20 H21 N O4 |
| Smiles: | Cc1cc(C)cc(c1)OC1=COc2c(ccc(c2CN(C)C)O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.4674 |
| logD: | 2.9541 |
| logSw: | -3.5911 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.69 |
| InChI Key: | QIEBLBCTPZCVSW-UHFFFAOYSA-N |