Basic information
- Standard SMILES
CSc1ccc(Cl)cc1NS(=O)(=O)c1ccc(Cl)cc1- InChIKey
QZSKVOTWQYLFRF-UHFFFAOYSA-N- Molecular formula
- C13H11Cl2NO2S2
- Average molar mass
- 348.3 g/mol
Names & identifiers
- Preferred name
- 4-chloro-N-[5-chloro-2-(methylthio)phenyl]benzenesulfonamide
- IUPAC
- 4-chloro-N-(5-chloro-2-methylsulfanylphenyl)benzenesulfonamide
Names & synonyms
4-chloro-N-[5-chloro-2-(methylthio)phenyl]benzenesulfonamideSCHEMBL9935394CHEMBL5977071QZSKVOTWQYLFRF-UHFFFAOYSA-NUS9663460, Example 33BDBM327244
Database identifiers
- PubChem CID
- 47419232
- ChEMBL
CHEMBL5977071
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 79.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 405
Related reactions
7 records
Compound notes
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