ethyl 6-bromo-7-[(4-methylphenyl)methoxy]-2-propanamido-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-bromo-7-[(4-methylphenyl)methoxy]-2-propanamido-1-benzothiophene-3-carboxylate
ethyl 6-bromo-7-[(4-methylphenyl)methoxy]-2-propanamido-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | G117-0506 |
| Compound Name: | ethyl 6-bromo-7-[(4-methylphenyl)methoxy]-2-propanamido-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 476.39 |
| Molecular Formula: | C22 H22 Br N O4 S |
| Smiles: | CCC(Nc1c(C(=O)OCC)c2ccc(c(c2s1)OCc1ccc(C)cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8708 |
| logD: | 5.8523 |
| logSw: | -5.7614 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.065 |
| InChI Key: | JDSWYXPZWTYJIG-UHFFFAOYSA-N |