C21 H22 Cl2 N2 O2
A1IX7
1-[2,5-bis(chloranyl)phenyl]carbonyl-~{N}-[(4-methylphenyl)methyl]piperidine-4-carboxamide
Description
Physiochemical properties
Bound structures
Interaction statistics
Ligand-specific databases
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Synonyms
1-[2,5-bis(chloranyl)phenyl]carbonyl-~{N}-[(4-methylphenyl)m...Show more
Formula
Standard InChI
InChI=1S/C21H22Cl2N2O2/c1-14-2-4-15(5-3-14)13-24-20(26)16-8-10-25(11-9-16)21(27)18-12-17(22)6-7-19(18)23/h2-7,12,16H,8-1...Show more
Standard InChI Key
HWTLZRSGBYUJIG-UHFFFAOYSA-N
SMILES
Cc1ccc(cc1)CNC(=O)C2CCN(CC2)C(=O)c3cc(ccc3Cl)Cl
Source OpenEye
First observed in
Overall view, and highlighted
scaffolds and fragments ![help icon]()
This image gallery displays several views of the ligand structure:
- Basic Structural Representation: Shows the overall structure of the ligand.
- Detailed Structural Representation: Highlights individual atoms within the ligand.
- Murcko Scaffold: Presents the scaffold of the ligand highlighted in yellow.
- Highlighted Fragments: Displays various ligand fragments, highlighted in yellow.
This image gallery displays several views of the ligand structure:
- Basic Structural Representation: Shows the overall structure of the ligand.
- Detailed Structural Representation: Highlights individual atoms within the ligand.
- Murcko Scaffold: Presents the scaffold of the ligand highlighted in yellow.
- Highlighted Fragments: Displays various ligand fragments, highlighted in yellow.
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