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TJ08

CAT: 0013-GTR19211987-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211987-04Size:25 mg
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Description
TJ08 is a 1,2,5-trisubstituted benzimidazole compound demonstrating anticancer activity. It functions by inducing G1/S phase cell cycle arrest and promoting apoptosis in various cancer cell lines. Its mechanism and efficacy have been investigated in both in vitro and in vivo preclinical studies.
CAS Number
2924274-19-9
Product Name Alternative
Apoptosis
Field of Research
Cell Biology
Purity
99.41% (May vary between batches)
Smiles
O=C (C1=CC=C2C (N=C (N2CC3=CC=CC=C3) C4=CC ([N+] ([O-]) =O) =C (F) C=C4) =C1) OC
Molecular Formula
C22H16FN3O4
Molecular Weight
405.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Methyl 1-benzyl-2-(4-fluoro-3-nitrophenyl)benzimidazole-5-carboxylate
CAS Number2924274-19-9
PubChem CID166642392
IUPAC Namemethyl 1-benzyl-2-(4-fluoro-3-nitrophenyl)benzimidazole-5-carboxylate
Molecular FormulaC22H16FN3O4
Molecular Weight405.4
XLogP4.5
Topological Polar Surface Area89.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity624
SMILES
COC(=O)C1=CC2=C(C=C1)N(C(=N2)C3=CC(=C(C=C3)F)[N+](=O)[O-])CC4=CC=CC=C4
InChI
InChI=1S/C22H16FN3O4/c1-30-22(27)16-8-10-19-18(11-16)24-21(25(19)13-14-5-3-2-4-6-14)15-7-9-17(23)20(12-15)26(28)29/h2-12H,13H2,1H3
InChIKey
JUSUUJMVLLBFGH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 1-benzyl-2-(4-fluoro-3-nitrophenyl)benzimidazole-5-carboxylate
CAS: 2924274-19-9
CID: 166642392
Formula: C22H16FN3O4
MW: 405.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight405.4
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass405.11248416
Monoisotopic Mass405.11248416
Topological Polar Surface Area89.9 Ų
Heavy Atom Count30
Formal Charge0
Complexity624
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

Alternative Products

CatalogName
T73577-01TJ08

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