Basic information
- Standard SMILES
CC(C)S(=O)(=O)Nc1ccsc1-c1ccc(-c2ccc(OCC(=O)O)cc2)cc1- InChIKey
QKBDUSBVSURVMO-UHFFFAOYSA-N- Molecular formula
- C21H21NO5S2
- Average molar mass
- 431.5 g/mol
Names & identifiers
- Preferred name
- {4'-[3-(Propane-2-sulfonylamino)-thiophen-2-yl]-biphenyl-4-yloxy}-acetic acid
- IUPAC
- 2-[4-[4-[3-(propan-2-ylsulfonylamino)thiophen-2-yl]phenyl]phenoxy]acetic acid
Names & synonyms
SCHEMBL4949928QKBDUSBVSURVMO-UHFFFAOYSA-N{4'-[3-(Propane-2-sulfonylamino)-thiophen-2-yl]-biphenyl-4-yloxy}-acetic acid
Database identifiers
- PubChem CID
- 69253225
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 632
Related reactions
2 records
Linked notes
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