ZLN005 - ≥95%(HPLC) , CAS No.49671-76-3

CAS: 49671-76-3 Cat. No.: Z170591 Molecular Weight: 250.34 EC Number: 806-177-8 PubChem CID: 899323

GRADE & PURITY ≥95%(HPLC)

Synonyms

AKOS003029495 | ZLN 005 | 2-(4-tert-butylphenyl)-1H-benzimidazole | SCHEMBL6755306 | TQS-168 | J-690308 | s7447 | 2-(4-(tert-butyl)phenyl)-1H-benzo[d]imidazole | 2-(4-t-butylphenyl) benzimidazole | BIM-0034399.P001 | 2-(4-tert-butylphenyl)-1H-benzo[d]imid

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

AKOS003029495 | ZLN 005 | 2-(4-tert-butylphenyl)-1H-benzimidazole | SCHEMBL6755306 | TQS-168 | J-690308 | s7447 | 2-(4-(tert-butyl)phenyl)-1H-benzo[d]imidazole | 2-(4-t-butylphenyl) benzimidazole | BIM-0034399.P001 | 2-(4-tert-butylphenyl)-1H-benzo[d]imid

Specifications & Purity

≥95%(HPLC)

Biochemical and Physiological Mechanisms

PGC-1α transcriptional activator. Activates AMPK. Stimulates PGC-1α expression. Increases fat oxidation. Improves glucose and pyruvate tolerance. Increases insulin sensitivity. Shows antidiabetic effects in vivo.

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥95%(HPLC)

Names and Identifiers

• Pubchem Sid: 504760309
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504760309
• Canonical Smiles: CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2
• IUPAC Name: 2-(4-tert-butylphenyl)-1H-benzimidazole
• InChIKey: LQUNNCQSFFKSSK-UHFFFAOYSA-N
• INCHI: 1S/C17H18N2/c1-17(2,3)13-10-8-12(9-11-13)16-18-14-6-4-5-7-15(14)19-16/h4-11H,1-3H3,(H,18,19)
• Isomeric SMILES: CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2
• WGK Germany: 3
• PubChem CID: 899323
• Molecular Weight: 250.34

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Benzimidazoles
      • Subclass Phenylbenzimidazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Benzimidazoles
• Subclass: Phenylbenzimidazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylbenzimidazoles
• Alternative Parents: Phenylimidazoles Phenylpropanes Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phenylbenzimidazole - 2-phenylimidazole - Phenylpropane - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylbenzimidazoles. These are compounds containing a phenylbenzimidazole skeleton, which consists of a benzimidazole moiety where its imidazole ring is attached to a phenyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 250.340 g/mol
• XLogP3: 4.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 250.147 Da
• Monoisotopic Mass: 250.147 Da
• Topological Polar Surface Area: 28.700 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 299.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1