AC1LX5Q6
methyl 4-(4-bromophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate
Also Known As: Oprea1_403763|AK-968/15256640|methyl 4-(4-bromophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate|methyl 4-(4-bromophenyl)-2-{[(3,4-dimethoxyphenyl)acetyl]amino}-3-thiophenecarboxylate|methyl 2-[2-(3,4-dimethoxyphenyl)acetylamino]-4-(4-bromophenyl)thiophene-3-car boxylate|methyl 4-(4-bromophenyl)-2-{[(3,4-dimethoxyphenyl)acetyl]amino}thiophene-3-carboxylate
| Molecular Formula | C22H20BrNO5S |
|---|---|
| Molecular Weight | 489.02457 g/mol |
| LogP | 5.1626 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 489.02457 |
| Monoisotopic Mass | 489.02457 |
| Heavy Atoms | 30 |
| Complexity | 1061.8899 |
Chemical Identifiers
| CAS Number | 545382-83-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OC)OC |
Product Overview
AC1LX5Q6 (CAS 545382-83-0), with molecular formula C22H20BrNO5S and molecular weight 489.02457 g/mol. IUPAC: methyl 4-(4-bromophenyl)-2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiophene-3-carboxylate.
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