Basic information
- Standard SMILES
O=c1cnc2ccc(F)cc2n1CCN1CCC(NCc2cc(-c3cccs3)on2)CC1- InChIKey
PAUUGJHUAJIELQ-UHFFFAOYSA-N- Molecular formula
- C23H24FN5O2S
- Average molar mass
- 453.5 g/mol
Names & identifiers
- Preferred name
- 7-fluoro-1-(2-(4-((5-(thiophen-2-yl)isoxazol-3-yl)methylamino)piperidin-1-yl)ethyl)quinoxalin-2(1H)-one
- IUPAC
- 7-fluoro-1-[2-[4-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylamino]piperidin-1-yl]ethyl]quinoxalin-2-one
Names & synonyms
SCHEMBL2796732PAUUGJHUAJIELQ-UHFFFAOYSA-N7-fluoro-1-(2-(4-((5-(thiophen-2-yl)isoxazol-3-yl)methylamino)piperidin-1-yl)ethyl)quinoxalin-2(1H)-one
Database identifiers
- PubChem CID
- 59398355
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 677
Related reactions
5 records
Compound notes
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