ethyl 2-acetamido-6-bromo-7-[2-(cyclohexylamino)-2-oxoethoxy]-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-acetamido-6-bromo-7-[2-(cyclohexylamino)-2-oxoethoxy]-1-benzothiophene-3-carboxylate
ethyl 2-acetamido-6-bromo-7-[2-(cyclohexylamino)-2-oxoethoxy]-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | L068-0537 |
| Compound Name: | ethyl 2-acetamido-6-bromo-7-[2-(cyclohexylamino)-2-oxoethoxy]-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 497.41 |
| Molecular Formula: | C21 H25 Br N2 O5 S |
| Smiles: | CCOC(c1c2ccc(c(c2sc1NC(C)=O)OCC(NC1CCCCC1)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2467 |
| logD: | 4.2362 |
| logSw: | -4.4235 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.374 |
| InChI Key: | IVIGURLKNFPJFS-UHFFFAOYSA-N |