2-((Difluoromethyl)sulfonyl)-1h-benzo[d]imidazol-6-amine
Basic information
- CAS
1249650-38-1- Standard SMILES
Nc1ccc2nc(S(=O)(=O)C(F)F)[nH]c2c1- InChIKey
DEWDLFLIVBKSAV-UHFFFAOYSA-N- Molecular formula
- C8H7F2N3O2S
- Average molar mass
- 247.22 g/mol
- Monoisotopic mass
- 247.02270397
Names & identifiers
- Preferred name
- 2-((Difluoromethyl)sulfonyl)-1h-benzo[d]imidazol-6-amine
- IUPAC
- 2-(difluoromethylsulfonyl)-3H-benzimidazol-5-amine
Names & synonyms
1249650-38-12-((Difluoromethyl)sulfonyl)-1h-benzo[d]imidazol-6-amine2-difluoromethanesulfonyl-1H-1,3-benzodiazol-6-amineC8H7F2N3O2SDTXSID001220269AKOS010626035CS-0284118EN300-12754242-(Difluoromethanesulfonyl)-1H-benzimidazol-6-amine2-(difluoromethylsulfonyl)-3H-benzimidazol-5-amine2-[(Difluoromethyl)sulfonyl]-1H-benzimidazol-6-amine
Database identifiers
- CAS
1249650-38-1- PubChem CID
- 61368591
- DTXSID
DTXSID001220269
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 97.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 357
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Compound notes
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