1H-Benzimidazole-5-carboxylic acid, 1,2-dimethyl-7-((methylamino)sulfonyl)-
Basic information
- CAS
72020-31-6- Standard SMILES
CNS(=O)(=O)c1cc(C(=O)O)cc2nc(C)n(C)c12- InChIKey
JDKLMPFWKDHSNO-UHFFFAOYSA-N- Molecular formula
- C11H13N3O4S
- Average molar mass
- 283.31 g/mol
- Monoisotopic mass
- 283.06267708
Names & identifiers
- Preferred name
- 1H-Benzimidazole-5-carboxylic acid, 1,2-dimethyl-7-((methylamino)sulfonyl)-
- IUPAC
- 1,2-dimethyl-7-(methylsulfamoyl)benzimidazole-5-carboxylic acid
Names & synonyms
BRN 093068772020-31-61H-BENZIMIDAZOLE-5-CARBOXYLIC ACID, 1,2-DIMETHYL-7-((METHYLAMINO)SULFONYL)-1,2-Dimethyl-7-((methylamino)sulfonyl)-1H-benzimidazole-5-carboxylic acidDTXSID80222329RefChem:237625DTXCID301448205-25-09-00242 (Beilstein Handbook Reference)1,2-Dimethyl-7-(methylsulfamoyl)-1H-1,3-benzimidazole-5-carboxylic acid
Database identifiers
- CAS
72020-31-6- PubChem CID
- 51512
- DTXSID
DTXSID80222329
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 461
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Compound notes
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