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TA 02

CAT: 0607-B4924-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0607-B4924-50Size:50 mg
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Description
p38 MAPK inhibitor
CAS Number
1784751-19-4
Product Name Alternative
4-(2-(2-fluorophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)pyridine
Field of Research
Stem Cell HSC
Purity
0.98
Form
A solid
Solubility
insoluble in H2O; ≥12.65 mg/mL in DMSO; ≥5.84 mg/mL in EtOH
Smiles
FC1=C(C2=NC(C3=CC=C(F)C=C3)=C(C4=CC=NC=C4)N2)C=CC=C1
Molecular Formula
C20H13F2N3
Molecular Weight
333.33
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

4-(2-(2-Fluorophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)pyridine
CAS Number1784751-19-4
PubChem CID91691130
IUPAC Name4-[2-(2-fluorophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine
Molecular FormulaC20H13F2N3
Molecular Weight333.3
XLogP4.2
Topological Polar Surface Area41.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity421
SMILES
C1=CC=C(C(=C1)C2=NC(=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)F
InChI
InChI=1S/C20H13F2N3/c21-15-7-5-13(6-8-15)18-19(14-9-11-23-12-10-14)25-20(24-18)16-3-1-2-4-17(16)22/h1-12H,(H,24,25)
InChIKey
QIFJOFNVIVQRNJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(2-(2-Fluorophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)pyridine
CAS: 1784751-19-4
CID: 91691130
Formula: C20H13F2N3
MW: 333.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight333.3
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass333.10775375
Monoisotopic Mass333.10775375
Topological Polar Surface Area41.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity421
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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