Basic information
- Standard SMILES
NS(=O)(=O)c1ccc(Sc2ccc(CC(=O)O)cc2)s1- InChIKey
VPVIGXWGPTYRIJ-UHFFFAOYSA-N- Molecular formula
- C12H11NO4S3
- Average molar mass
- 329.4 g/mol
Names & identifiers
- Preferred name
- 5-(4-Carboxymethylphenylthio)thiophene-2-sulfonamide
- IUPAC
- 2-[4-(5-sulfamoylthiophen-2-yl)sulfanylphenyl]acetic acid
Names & synonyms
SCHEMBL9828623VPVIGXWGPTYRIJ-UHFFFAOYSA-N5-(4-carboxymethylphenylthio)thiophene-2-sulfonamide
Database identifiers
- PubChem CID
- 20033693
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 440
Related reactions
2 records
Compound notes
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