2-(Benzylthio)-3-(2-thienyl)quinoxaline
Basic information
- Standard SMILES
c1ccc(CSc2nc3ccccc3nc2-c2cccs2)cc1- InChIKey
UNWXUHPFCOSAFU-UHFFFAOYSA-N- Molecular formula
- C19H14N2S2
- Average molar mass
- 334.5 g/mol
- Monoisotopic mass
- 334.0598408
Names & identifiers
- Preferred name
- 2-(Benzylthio)-3-(2-thienyl)quinoxaline
- IUPAC
- 2-benzylsulfanyl-3-thiophen-2-ylquinoxaline
Names & synonyms
NSC6527672-(Benzylthio)-3-(2-thienyl)quinoxalineCHEMBL1994932NSC-652767NCI60_0184562-benzylsulfanyl-3-(2-thienyl)quinoxalineBenzyl 3-(2-thienyl)-2-quinoxalinyl sulfide
Database identifiers
- PubChem CID
- 374667
- ChEMBL
CHEMBL1994932- Nikkaji
- J779.668D
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 79.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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