Basic information
- CAS
138336-22-8- Standard SMILES
Cc1cnc2c(ccc3c2nc(S(C)(=O)=O)n3C)n1- InChIKey
HUXDNMNDZRIFOM-UHFFFAOYSA-N- Molecular formula
- C12H12N4O2S
- Average molar mass
- 276.32 g/mol
- Monoisotopic mass
- 276.06809681
Names & identifiers
- Preferred name
- Imidazo(4,5-f)quinoxaline, 2-(methylsulfonyl)-3,7-trimethyl-
- IUPAC
- 3,7-dimethyl-2-methylsulfonylimidazo[4,5-f]quinoxaline
Names & synonyms
138336-22-8Imidazo(4,5-f)quinoxaline, 2-(methylsulfonyl)-3,7-trimethyl-3,7-Dimethyl-2-(methylsulfonyl)imidazo(4,5-f)quinoxalineDTXSID001606132-(Methanesulfonyl)-3,7-dimethyl-3H-imidazo[4,5-f]quinoxaline
Database identifiers
- CAS
138336-22-8- PubChem CID
- 178485
- DTXSID
DTXSID00160613
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 86.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 449
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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