methyl 5'-{2-[2-(propan-2-yl)phenoxy]acetamido}[2,3'-bithiophene]-4'-carboxylate
Chemical Structure Depiction of
methyl 5'-{2-[2-(propan-2-yl)phenoxy]acetamido}[2,3'-bithiophene]-4'-carboxylate
methyl 5'-{2-[2-(propan-2-yl)phenoxy]acetamido}[2,3'-bithiophene]-4'-carboxylate
Compound characteristics
Compound ID: | D304-0090 |
Compound Name: | methyl 5'-{2-[2-(propan-2-yl)phenoxy]acetamido}[2,3'-bithiophene]-4'-carboxylate |
Molecular Weight: | 415.53 |
Molecular Formula: | C21 H21 N O4 S2 |
Smiles: | CC(C)c1ccccc1OCC(Nc1c(C(=O)OC)c(cs1)c1cccs1)=O |
Stereo: | ACHIRAL |
logP: | 5.3479 |
logD: | 5.3234 |
logSw: | -5.4007 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.417 |
InChI Key: | SWBAWPCDRJQGJP-UHFFFAOYSA-N |