4-methyl-N-[2-(4-methylphenyl)ethyl]-N-(4-methylphenyl)sulfonylbenzenesulfonamide
Basic information
- CAS
67508-24-1- Standard SMILES
Cc1ccc(CCN(S(=O)(=O)c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1- InChIKey
LQFPRMLZDJYHKJ-UHFFFAOYSA-N- Molecular formula
- C23H25NO4S2
- Average molar mass
- 443.6 g/mol
- Monoisotopic mass
- 443.12250063
Names & identifiers
- Preferred name
- 4-methyl-N-[2-(4-methylphenyl)ethyl]-N-(4-methylphenyl)sulfonylbenzenesulfonamide
- IUPAC
- 4-methyl-N-[2-(4-methylphenyl)ethyl]-N-(4-methylphenyl)sulfonylbenzenesulfonamide
Names & synonyms
67508-24-1NSC2739374-methyl-N-[2-(4-methylphenyl)ethyl]-N-(4-methylphenyl)sulfonylbenzenesulfonamideDTXSID50313657NSC-2739374-methyl-N-(4-methylphenethyl)-N-tosylbenzenesulfonamide4-Methyl-N-(4-methylbenzene-1-sulfonyl)-N-[2-(4-methylphenyl)ethyl]benzene-1-sulfonamide
Database identifiers
- CAS
67508-24-1- PubChem CID
- 321641
- DTXSID
DTXSID50313657
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 88.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 677
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Compound notes
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