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NR2F6 modulator-2

CAT: 0804-HY-W649594-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W649594-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
NR2F6 modulator-2 (Compound I) is an autorepressed orphan nuclear receptor NR2F6 (Nuclear Receptor subfamily 2 group F member 6) modulator. NR2F6 modulator-2 can inhibits the recruitment of the bio-NSD1 peptide with an IC50 of 2.0 equivalents of NR2F6. NR2F6 modulator-2 can be used for the researches of cancer and immunology[1].
CAS Number
22978-55-8
UNSPSC
12352005
Hazard Statement
H315-H319-H335
Target
Orphan Nuclear Receptor
Related Pathways
Vitamin D Related/Nuclear Receptor
Applications
COVID-19-immunoregulation
Field of Research
Cancer; Inflammation/Immunology
Smiles
OC1=CC=C(NC(=O)C2=CC(=CC=C2Cl)[N+]([O-])=O)C=C1
Molecular Formula
C13H9ClN2O4
Molecular Weight
292.67
Precautions
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P362-P403+P233-P405-P501
References & Citations
[1]Oerlemans GJM, et al. Structural Elucidation and Covalent Modulation of the Autorepressed Orphan Nuclear Receptor NR2F6. ACS Chem Biol. 2025 Sep 19;20 (9) :2308-2317.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

2-chloro-N-(4-hydroxyphenyl)-5-nitrobenzamide
CAS Number22978-55-8
PubChem CID7131689
IUPAC Name2-chloro-N-(4-hydroxyphenyl)-5-nitrobenzamide
Molecular FormulaC13H9ClN2O4
Molecular Weight292.67
XLogP3
Topological Polar Surface Area95.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity366
SMILES
C1=CC(=CC=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl)O
InChI
InChI=1S/C13H9ClN2O4/c14-12-6-3-9(16(19)20)7-11(12)13(18)15-8-1-4-10(17)5-2-8/h1-7,17H,(H,15,18)
InChIKey
CGKVYRMRNZJQNG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-chloro-N-(4-hydroxyphenyl)-5-nitrobenzamide
CAS: 22978-55-8
CID: 7131689
Formula: C13H9ClN2O4
MW: 292.67
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight292.67
XLogP33
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass292.0250845
Monoisotopic Mass292.0250845
Topological Polar Surface Area95.2 Ų
Heavy Atom Count20
Formal Charge0
Complexity366
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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