methyl 5'-{2-[4-bromo-2-(propan-2-yl)phenoxy]acetamido}[2,3'-bithiophene]-4'-carboxylate
Chemical Structure Depiction of
methyl 5'-{2-[4-bromo-2-(propan-2-yl)phenoxy]acetamido}[2,3'-bithiophene]-4'-carboxylate
methyl 5'-{2-[4-bromo-2-(propan-2-yl)phenoxy]acetamido}[2,3'-bithiophene]-4'-carboxylate
Compound characteristics
| Compound ID: | D304-0133 |
| Compound Name: | methyl 5'-{2-[4-bromo-2-(propan-2-yl)phenoxy]acetamido}[2,3'-bithiophene]-4'-carboxylate |
| Molecular Weight: | 494.42 |
| Molecular Formula: | C21 H20 Br N O4 S2 |
| Smiles: | CC(C)c1cc(ccc1OCC(Nc1c(C(=O)OC)c(cs1)c1cccs1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.0429 |
| logD: | 6.0184 |
| logSw: | -5.5238 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.417 |
| InChI Key: | DYYRCQRECNKOJD-UHFFFAOYSA-N |