3-(3,5-dimethylphenoxy)-7-hydroxy-2-methyl-8-[(4-methylpiperidin-1-yl)methyl]-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(3,5-dimethylphenoxy)-7-hydroxy-2-methyl-8-[(4-methylpiperidin-1-yl)methyl]-4H-1-benzopyran-4-one
3-(3,5-dimethylphenoxy)-7-hydroxy-2-methyl-8-[(4-methylpiperidin-1-yl)methyl]-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | D088-0056 |
| Compound Name: | 3-(3,5-dimethylphenoxy)-7-hydroxy-2-methyl-8-[(4-methylpiperidin-1-yl)methyl]-4H-1-benzopyran-4-one |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C25 H29 N O4 |
| Smiles: | CC1CCN(CC1)Cc1c(ccc2C(C(=C(C)Oc12)Oc1cc(C)cc(C)c1)=O)O |
| Stereo: | ACHIRAL |
| logP: | 5.3065 |
| logD: | 4.491 |
| logSw: | -5.1621 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.628 |
| InChI Key: | QHDHOTGPFKAILP-UHFFFAOYSA-N |