methyl {4,8-dimethyl-7-[2-(4-methylanilino)-2-oxoethoxy]-2-oxo-2H-1-benzopyran-3-yl}acetate
Chemical Structure Depiction of
methyl {4,8-dimethyl-7-[2-(4-methylanilino)-2-oxoethoxy]-2-oxo-2H-1-benzopyran-3-yl}acetate
methyl {4,8-dimethyl-7-[2-(4-methylanilino)-2-oxoethoxy]-2-oxo-2H-1-benzopyran-3-yl}acetate
Compound characteristics
| Compound ID: | Y040-4064 |
| Compound Name: | methyl {4,8-dimethyl-7-[2-(4-methylanilino)-2-oxoethoxy]-2-oxo-2H-1-benzopyran-3-yl}acetate |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C23 H23 N O6 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2c1ccc(c2C)OCC(Nc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9424 |
| logD: | 3.9424 |
| logSw: | -4.221 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.887 |
| InChI Key: | QEQFYFDRXKXCRM-UHFFFAOYSA-N |