methyl 2-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
Chemical Structure Depiction of
methyl 2-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
methyl 2-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate
Compound characteristics
| Compound ID: | C711-0434 |
| Compound Name: | methyl 2-{[3-methoxy-4-(2-methylpropoxy)phenyl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-5-carboxylate |
| Molecular Weight: | 382.41 |
| Molecular Formula: | C22 H22 O6 |
| Smiles: | [H]C(=C1/C(c2cc(ccc2O1)C(=O)OC)=O)\c1ccc(c(c1)OC)OCC(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.8496 |
| logD: | 4.8496 |
| logSw: | -4.6715 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.753 |
| InChI Key: | FQTGLAHXUFXARQ-UHFFFAOYSA-N |