methyl 2-[2-(4-bromophenyl)acetamido]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[2-(4-bromophenyl)acetamido]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
methyl 2-[2-(4-bromophenyl)acetamido]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y501-0853 |
| Compound Name: | methyl 2-[2-(4-bromophenyl)acetamido]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate |
| Molecular Weight: | 490.37 |
| Molecular Formula: | C22 H20 Br N O5 S |
| Smiles: | COC(c1c(csc1NC(Cc1ccc(cc1)[Br])=O)c1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5427 |
| logD: | 4.4876 |
| logSw: | -4.5715 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.074 |
| InChI Key: | ICDYBPHWOQAXKP-UHFFFAOYSA-N |