Basic information
- Standard SMILES
O=S(=O)(Nc1ccccc1CO)c1cccc(S(=O)(=O)Nc2ccccc2CO)c1- InChIKey
YQXNXOIRKXPDDS-UHFFFAOYSA-N- Molecular formula
- C20H20N2O6S2
- Average molar mass
- 448.5 g/mol
Names & identifiers
- Preferred name
- N,N'-bis(o-hydroxymethylphenyl)benzene-m-disulfonamide
- IUPAC
- 1-N,3-N-bis[2-(hydroxymethyl)phenyl]benzene-1,3-disulfonamide
Names & synonyms
SCHEMBL9329231YQXNXOIRKXPDDS-UHFFFAOYSA-NN,N'-bis(o-hydroxymethylphenyl)benzene-m-disulfonamide
Database identifiers
- PubChem CID
- 54522642
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 684
Related reactions
1 records
Compound notes
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