methyl 2-acetamido-6-bromo-7-[2-(2-ethylanilino)-2-oxoethoxy]-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-acetamido-6-bromo-7-[2-(2-ethylanilino)-2-oxoethoxy]-1-benzothiophene-3-carboxylate
methyl 2-acetamido-6-bromo-7-[2-(2-ethylanilino)-2-oxoethoxy]-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | L068-0666 |
| Compound Name: | methyl 2-acetamido-6-bromo-7-[2-(2-ethylanilino)-2-oxoethoxy]-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 505.39 |
| Molecular Formula: | C22 H21 Br N2 O5 S |
| Smiles: | CCc1ccccc1NC(COc1c(ccc2c(C(=O)OC)c(NC(C)=O)sc12)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5134 |
| logD: | 4.5029 |
| logSw: | -4.533 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.049 |
| InChI Key: | DOUMMLYIKNRWCC-UHFFFAOYSA-N |