ethyl 5-acetyl-2-[2-(4-bromo-3-methylphenoxy)acetamido]-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-2-[2-(4-bromo-3-methylphenoxy)acetamido]-4-methylthiophene-3-carboxylate
ethyl 5-acetyl-2-[2-(4-bromo-3-methylphenoxy)acetamido]-4-methylthiophene-3-carboxylate
Compound characteristics
Compound ID: | 2595-1217 |
Compound Name: | ethyl 5-acetyl-2-[2-(4-bromo-3-methylphenoxy)acetamido]-4-methylthiophene-3-carboxylate |
Molecular Weight: | 454.34 |
Molecular Formula: | C19 H20 Br N O5 S |
Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(COc1ccc(c(C)c1)[Br])=O)=O |
Stereo: | ACHIRAL |
logP: | 4.2356 |
logD: | 1.5044 |
logSw: | -4.4189 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.99 |
InChI Key: | KEJBLOWRYCGELG-UHFFFAOYSA-N |