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TA-01

CAT: 1410-M12689-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1410-M12689-07Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
A potent inhibitor of Casein Kinase CK1ε, CK1δ and p38α with IC50 of 6.4, 6.8 and 6.7 nM, respectively.
CAS Number
1784751-18-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
351.3246
Molecular Formula
C20H12F3N3
Notes
Research use only, not for human use.
Receptor
CKIδ|CKIϵ|p38MAPkinase

Chemical Information

4-[2-(2,6-difluorophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine
CAS Number1784751-18-3
PubChem CID91691129
IUPAC Name4-[2-(2,6-difluorophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine
Molecular FormulaC20H12F3N3
Molecular Weight351.3
XLogP4.3
Topological Polar Surface Area41.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity442
SMILES
C1=CC(=C(C(=C1)F)C2=NC(=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)F
InChI
InChI=1S/C20H12F3N3/c21-14-6-4-12(5-7-14)18-19(13-8-10-24-11-9-13)26-20(25-18)17-15(22)2-1-3-16(17)23/h1-11H,(H,25,26)
InChIKey
TWPJJJZCYVFUOA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-[2-(2,6-difluorophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine
CAS: 1784751-18-3
CID: 91691129
Formula: C20H12F3N3
MW: 351.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight351.3
XLogP34.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass351.09833188
Monoisotopic Mass351.09833188
Topological Polar Surface Area41.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity442
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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