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Basic information
- Standard SMILES
O=S(Cc1ccccn1)c1nc2ccccc2nc1-c1ccccc1- InChIKey
GZHHJTLCHPDKSZ-UHFFFAOYSA-N- Molecular formula
- C20H15N3OS
- Average molar mass
- 345.4 g/mol
- Monoisotopic mass
- 345.09358328
Names & identifiers
- Preferred name
- 2-Phenyl-3-((2-pyridinylmethyl)sulfinyl)quinoxaline
- IUPAC
- 2-phenyl-3-(pyridin-2-ylmethylsulfinyl)quinoxaline
Names & synonyms
NSC6527722-Phenyl-3-((2-pyridinylmethyl)sulfinyl)quinoxaline3-Phenyl-2-quinoxalinyl 2-pyridinylmethyl sulfoxideCHEMBL1986120NSC-652772NCI60_0184612-phenyl-3-(2-pyridylmethylsulfinyl)quinoxaline
Database identifiers
- PubChem CID
- 374672
- ChEMBL
CHEMBL1986120- Nikkaji
- J628.578C
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 75 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 454
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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