ethyl 2-acetamido-6-bromo-7-[3-(diethylamino)-2-hydroxypropoxy]-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-acetamido-6-bromo-7-[3-(diethylamino)-2-hydroxypropoxy]-1-benzothiophene-3-carboxylate
ethyl 2-acetamido-6-bromo-7-[3-(diethylamino)-2-hydroxypropoxy]-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 8010-1958 |
| Compound Name: | ethyl 2-acetamido-6-bromo-7-[3-(diethylamino)-2-hydroxypropoxy]-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 487.41 |
| Molecular Formula: | C20 H27 Br N2 O5 S |
| Smiles: | CCN(CC)CC(COc1c(ccc2c(C(=O)OCC)c(NC(C)=O)sc12)[Br])O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.573 |
| logD: | 2.0802 |
| logSw: | -3.8535 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.502 |
| InChI Key: | NCLPRVKNBJKYKM-ZDUSSCGKSA-N |