methyl {8-[(diethylamino)methyl]-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetate
Chemical Structure Depiction of
methyl {8-[(diethylamino)methyl]-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetate
methyl {8-[(diethylamino)methyl]-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetate
Compound characteristics
| Compound ID: | D635-0027 |
| Compound Name: | methyl {8-[(diethylamino)methyl]-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl}acetate |
| Molecular Weight: | 333.38 |
| Molecular Formula: | C18 H23 N O5 |
| Smiles: | CCN(CC)Cc1c(ccc2C(C)=C(CC(=O)OC)C(=O)Oc12)O |
| Stereo: | ACHIRAL |
| logP: | 2.4904 |
| logD: | 1.4445 |
| logSw: | -2.6802 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.404 |
| InChI Key: | UEVBZABNKFGAJA-UHFFFAOYSA-N |