Basic information
- CAS
138336-13-7- Standard SMILES
CSc1nc2c3ncc(C)nc3ccc2n1C- InChIKey
MGUIQHYVPMSMCY-UHFFFAOYSA-N- Molecular formula
- C12H12N4S
- Average molar mass
- 244.32 g/mol
- Monoisotopic mass
- 244.07826757
Names & identifiers
- Preferred name
- Imidazo(4,5-f)quinoxaline, 2-(methylthio)-3,7-dimethyl-
- IUPAC
- 3,7-dimethyl-2-methylsulfanylimidazo[4,5-f]quinoxaline
Names & synonyms
138336-13-7Imidazo(4,5-f)quinoxaline, 2-(methylthio)-3,7-dimethyl-3,7-Dimethyl-2-(methylthio)imidazo(4,5-f)quinoxalineDTXSID101606043,7-Dimethyl-2-(methylsulfanyl)-3H-imidazo[4,5-f]quinoxaline
Database identifiers
- CAS
138336-13-7- PubChem CID
- 178476
- DTXSID
DTXSID10160604
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 68.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 288
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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