ethyl 2-acetamido-6-bromo-7-{2-[methyl(phenyl)amino]-2-oxoethoxy}-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-acetamido-6-bromo-7-{2-[methyl(phenyl)amino]-2-oxoethoxy}-1-benzothiophene-3-carboxylate
ethyl 2-acetamido-6-bromo-7-{2-[methyl(phenyl)amino]-2-oxoethoxy}-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | L068-0483 |
| Compound Name: | ethyl 2-acetamido-6-bromo-7-{2-[methyl(phenyl)amino]-2-oxoethoxy}-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 505.39 |
| Molecular Formula: | C22 H21 Br N2 O5 S |
| Smiles: | CCOC(c1c2ccc(c(c2sc1NC(C)=O)OCC(N(C)c1ccccc1)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6478 |
| logD: | 3.6374 |
| logSw: | -4.1843 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.291 |
| InChI Key: | ADMBZNOHHDUZHG-UHFFFAOYSA-N |