ethyl 3-{7-[(6-chloro-2H-1,3-benzodioxol-5-yl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{7-[(6-chloro-2H-1,3-benzodioxol-5-yl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
ethyl 3-{7-[(6-chloro-2H-1,3-benzodioxol-5-yl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
Compound characteristics
| Compound ID: | Y040-3883 |
| Compound Name: | ethyl 3-{7-[(6-chloro-2H-1,3-benzodioxol-5-yl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate |
| Molecular Weight: | 444.87 |
| Molecular Formula: | C23 H21 Cl O7 |
| Smiles: | CCOC(CCC1=C(C)c2ccc(cc2OC1=O)OCc1cc2c(cc1[Cl])OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.863 |
| logD: | 4.863 |
| logSw: | -4.904 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.662 |
| InChI Key: | BORHJIRIUKJFMP-UHFFFAOYSA-N |