Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)NCC(NS(=O)(=O)c2ccc(C)cc2)c2ccccc2)cc1- InChIKey
HOIVORUOLGPEAX-UHFFFAOYSA-N- Molecular formula
- C22H24N2O4S2
- Average molar mass
- 444.6 g/mol
- Monoisotopic mass
- 444.1177496
Names & identifiers
- Preferred name
- N,N'-Di(p-toluenesulfonyl)-1,2-diamino-1-phenylethane
- IUPAC
- 4-methyl-N-[2-[(4-methylphenyl)sulfonylamino]-2-phenylethyl]benzenesulfonamide
Names & synonyms
SCHEMBL8200065HOIVORUOLGPEAX-UHFFFAOYSA-NAKOS002844347N, N'-Di(p-toluenesulfonyl)-1,2-diamino-1-phenylethaneN,N'-Di(p-toluenesulfonyl)-1,2-diamino-1-phenylethane
Database identifiers
- PubChem CID
- 3974528
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 720
Related reactions
4 records
Compound notes
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