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α-Glucosidase-IN-22

CAT: 0804-HY-152158-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-152158-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
α-Glucosidase-IN-22 (compound 7i), a benzimidazole, is a potent α-glucosidase inhibitor with an IC50 of 0.64 μM. α-Glucosidase-IN-22 is a potent anti-diabetic agent and has the potential for type 2 diabetes mellitus (T2DM) research[1].
CAS Number
2870693-28-8
UNSPSC
12352005
Hazard Statement
H302-H315-H319
Target
Glycosidase
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-sugar/lipid metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/α-glucosidase-in-22.html
Purity
99.13
Solubility
DMSO : 125 mg/mL (ultrasonic)
Smiles
S=C1NC2=CC=C(C=C2N1)/N=C/C3=CC=C(C=C3O)O
Molecular Formula
C14H11N3O2S
Molecular Weight
285.32
Precautions
P264-P270-P280-P302+P352-P305+P351+P338-P330-P362+P364-P501
References & Citations
[1]Sardar Ali, et al. Novel 5- (Arylideneamino) -1 H-Benzo[ d]imidazole-2-thiols as Potent Anti-Diabetic Agents: Synthesis, In Vitro α-Glucosidase Inhibition, and Molecular Docking Studies. ACS Omega. 2022 Nov 23;7 (48) :43468-43479.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

5-((2,4-Dihydroxybenzylidene)amino)-1,3-dihydro-2H-benzo[d]imidazole-2-thione
CAS Number2870693-28-8
PubChem CID157345629
IUPAC Name5-[(2,4-dihydroxyphenyl)methylideneamino]-1,3-dihydrobenzimidazole-2-thione
Molecular FormulaC14H11N3O2S
Molecular Weight285.32
XLogP1.8
Topological Polar Surface Area109
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity404
SMILES
C1=CC2=C(C=C1N=CC3=C(C=C(C=C3)O)O)NC(=S)N2
InChI
InChI=1S/C14H11N3O2S/c18-10-3-1-8(13(19)6-10)7-15-9-2-4-11-12(5-9)17-14(20)16-11/h1-7,18-19H,(H2,16,17,20)
InChIKey
BGXWDJFZASQDKH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-((2,4-Dihydroxybenzylidene)amino)-1,3-dihydro-2H-benzo[d]imidazole-2-thione
CAS: 2870693-28-8
CID: 157345629
Formula: C14H11N3O2S
MW: 285.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight285.32
XLogP31.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass285.05719778
Monoisotopic Mass285.05719778
Topological Polar Surface Area109 Ų
Heavy Atom Count20
Formal Charge0
Complexity404
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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