ethyl 3-{6-chloro-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-{6-chloro-7-[(6-chloro-2H-1,3-benzodioxol-5-yl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
ethyl 3-{6-chloro-7-[(6-chloro-2H-1,3-benzodioxol-5-yl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
Compound characteristics
| Compound ID: | Y040-2265 |
| Compound Name: | ethyl 3-{6-chloro-7-[(6-chloro-2H-1,3-benzodioxol-5-yl)methoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate |
| Molecular Weight: | 479.31 |
| Molecular Formula: | C23 H20 Cl2 O7 |
| Smiles: | CCOC(CCC1=C(C)c2cc(c(cc2OC1=O)OCc1cc2c(cc1[Cl])OCO2)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9291 |
| logD: | 5.9291 |
| logSw: | -6.0989 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.748 |
| InChI Key: | RENOVFNRSSLORA-UHFFFAOYSA-N |