2-(Benzylsulfinyl)-3-(2-thienyl)quinoxaline
Basic information
- Standard SMILES
O=S(Cc1ccccc1)c1nc2ccccc2nc1-c1cccs1- InChIKey
PYHGYMDSADRIIM-UHFFFAOYSA-N- Molecular formula
- C19H14N2OS2
- Average molar mass
- 350.5 g/mol
- Monoisotopic mass
- 350.05475542
Names & identifiers
- Preferred name
- 2-(Benzylsulfinyl)-3-(2-thienyl)quinoxaline
- IUPAC
- 2-benzylsulfinyl-3-thiophen-2-ylquinoxaline
Names & synonyms
NSC6527682-(Benzylsulfinyl)-3-(2-thienyl)quinoxalineCHEMBL2001417NSC-652768NCI60_0184572-benzylsulfinyl-3-(2-thienyl)quinoxalineBenzyl 3-(2-thienyl)-2-quinoxalinyl sulfoxide
Database identifiers
- PubChem CID
- 374668
- ChEMBL
CHEMBL2001417- Nikkaji
- J779.675G
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 90.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 441
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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