Basic information
- Standard SMILES
Cc1ccc(C(=O)c2cc(Cl)ccc2NS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cn1- InChIKey
NJJBNAKDZXDSKH-UHFFFAOYSA-N- Molecular formula
- C20H17ClN2O5S2
- Average molar mass
- 464.9 g/mol
Names & identifiers
- Preferred name
- N-[4-Chloro-2-(6-methyl-pyridine-3-carbonyl)-phenyl]-4-methanesulfonyl-benzenesulfonamide
- IUPAC
- N-[4-chloro-2-(6-methylpyridine-3-carbonyl)phenyl]-4-methylsulfonylbenzenesulfonamide
Names & synonyms
SCHEMBL343754CHEMBL3719382NJJBNAKDZXDSKH-UHFFFAOYSA-NN-[4-Chloro-2-(6-methyl-pyridine-3-carbonyl)-phenyl]-4-methanesulfonyl-benzenesulfonamide
Database identifiers
- PubChem CID
- 10367205
- ChEMBL
CHEMBL3719382
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 813
Related reactions
5 records
Compound notes
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