5-(4-Methoxyphenyl)-4-methyl-3-(4-sulfamoylphenyl)thiophene-2-carboxylic acid
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Basic information
- Standard SMILES
COc1ccc(-c2sc(C(=O)O)c(-c3ccc(S(N)(=O)=O)cc3)c2C)cc1- InChIKey
ZQKJWCBFFNJPLF-UHFFFAOYSA-N- Molecular formula
- C19H17NO5S2
- Average molar mass
- 403.5 g/mol
- Monoisotopic mass
- 403.05481499
Names & identifiers
- Preferred name
- 5-(4-Methoxyphenyl)-4-methyl-3-(4-sulfamoylphenyl)thiophene-2-carboxylic acid
- IUPAC
- 5-(4-methoxyphenyl)-4-methyl-3-(4-sulfamoylphenyl)thiophene-2-carboxylic acid
Names & synonyms
SCHEMBL12482616ZQKJWCBFFNJPLF-UHFFFAOYSA-N5-(4-methoxyphenyl)-4-methyl-3-(4-sulfamoylphenyl)thiophene-2-carboxylic acid
Database identifiers
- PubChem CID
- 68285232
Properties
Computed structural propertiesFilling in
- XLogP
- 3.7
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 619
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Related reactions
4 records
Compound notes
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