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SR10098

CAT: 0013-GTR19277646-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19277646-01Size:1 mg
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Description
SR10098 is a high-affinity ligand for the NR4A nuclear receptor family that exhibits significant activating activity toward Nurr1 (NR4A2) (EC50 = 24 nM) and modulatory effects on other members of the NR4A family (Nur77, Nor1) . Nurr1 is involved in regulating the development, survival, and maintenance of dopaminergic neurons. Therefore, SR10098 can be used in research on Parkinson’s disease (PD) and neurodegenerative disorders.
CAS Number
850705-30-5
Smiles
O=C (O) C1=CC=C2N=C (NC2=C1) C=3C=CC (F) =CC3
Molecular Formula
C14H9FN2O2
Molecular Weight
256.23
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-(4-fluorophenyl)-1H-1,3-benzodiazole-6-carboxylic acid
CAS Number850705-30-5
PubChem CID17010630
IUPAC Name2-(4-fluorophenyl)-3H-benzimidazole-5-carboxylic acid
Molecular FormulaC14H9FN2O2
Molecular Weight256.23
XLogP2.9
Topological Polar Surface Area66
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity344
SMILES
C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)C(=O)O)F
InChI
InChI=1S/C14H9FN2O2/c15-10-4-1-8(2-5-10)13-16-11-6-3-9(14(18)19)7-12(11)17-13/h1-7H,(H,16,17)(H,18,19)
InChIKey
YLECAKVNZMDMNS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-fluorophenyl)-1H-1,3-benzodiazole-6-carboxylic acid
CAS: 850705-30-5
CID: 17010630
Formula: C14H9FN2O2
MW: 256.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.23
XLogP32.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass256.06480570
Monoisotopic Mass256.06480570
Topological Polar Surface Area66 Ų
Heavy Atom Count19
Formal Charge0
Complexity344
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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