Basic information
- CAS
67536-99-6- Standard SMILES
Cc1ccc(CN(S(=O)(=O)c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1- InChIKey
ATYPPEYODAUGEZ-UHFFFAOYSA-N- Molecular formula
- C22H23NO4S2
- Average molar mass
- 429.6 g/mol
- Monoisotopic mass
- 429.10685056
Names & identifiers
- Preferred name
- 4-methyl-N-[(4-methylphenyl)methyl]-N-(4-methylphenyl)sulfonylbenzenesulfonamide
- IUPAC
- 4-methyl-N-[(4-methylphenyl)methyl]-N-(4-methylphenyl)sulfonylbenzenesulfonamide
Names & synonyms
67536-99-6NSC2685014-methyl-N-[(4-methylphenyl)methyl]-N-(4-methylphenyl)sulfonylbenzenesulfonamideDTXSID70313295NSC-2685014-Methyl-N-(4-methylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl]benzene-1-sulfonamide
Database identifiers
- CAS
67536-99-6- PubChem CID
- 320528
- DTXSID
DTXSID70313295
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 88.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 662
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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