ethyl 4-bromo-2-formyl-7-methyl-5-[(2-methylbenzoyl)oxy]-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
ethyl 4-bromo-2-formyl-7-methyl-5-[(2-methylbenzoyl)oxy]-1-benzofuran-3-carboxylate
ethyl 4-bromo-2-formyl-7-methyl-5-[(2-methylbenzoyl)oxy]-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 1486-0317 |
| Compound Name: | ethyl 4-bromo-2-formyl-7-methyl-5-[(2-methylbenzoyl)oxy]-1-benzofuran-3-carboxylate |
| Molecular Weight: | 445.27 |
| Molecular Formula: | C21 H17 Br O6 |
| Smiles: | CCOC(c1c2c(c(cc(C)c2oc1C=O)OC(c1ccccc1C)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9322 |
| logD: | 4.9322 |
| logSw: | -4.9548 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.545 |
| InChI Key: | IMBVUZAAQDHRPC-UHFFFAOYSA-N |