2-Amino-4-[(3,4-dimethylphenyl)sulfamoyl]butanoic acid
Basic information
- Standard SMILES
Cc1ccc(NS(=O)(=O)CCC(N)C(=O)O)cc1C- InChIKey
RJSYAZBNNCCFAN-UHFFFAOYSA-N- Molecular formula
- C12H18N2O4S
- Average molar mass
- 286.35 g/mol
- Monoisotopic mass
- 286.09872823
Names & identifiers
- Preferred name
- 2-Amino-4-[(3,4-dimethylphenyl)sulfamoyl]butanoic acid
- IUPAC
- 2-amino-4-[(3,4-dimethylphenyl)sulfamoyl]butanoic acid
Names & synonyms
NSC21925NSC-21925
Database identifiers
- PubChem CID
- 228795
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 404
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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