1. Cell Cycle/DNA Damage
    Epigenetics
    GPCR/G Protein
  2. HDAC
    Adenosine Receptor
  3. A2AAR/HDAC-IN-1

A2AAR/HDAC-IN-1 

Cat. No.: HY-143324
Handling Instructions

A2AAR/HDAC-IN-1 (compound 14c) is an orally active, potent and balanced A2AAR/HDAC dual inhibitor, with a Ki of 163.5 nM for A2AAR and an IC50 of 145.3 nM for HDAC1. A2AAR/HDAC-IN-1 shows anticancer activity.

For research use only. We do not sell to patients.

A2AAR/HDAC-IN-1 Chemical Structure

A2AAR/HDAC-IN-1 Chemical Structure

CAS No. : 2767560-51-8

Size Stock
100 mg   Get quote  
250 mg   Get quote  
500 mg   Get quote  

* Please select Quantity before adding items.

Top Publications Citing Use of Products
  • Biological Activity

  • Purity & Documentation

  • References

  • Customer Review

Description

A2AAR/HDAC-IN-1 (compound 14c) is an orally active, potent and balanced A2AAR/HDAC dual inhibitor, with a Ki of 163.5 nM for A2AAR and an IC50 of 145.3 nM for HDAC1. A2AAR/HDAC-IN-1 shows anticancer activity[1].

IC50 & Target

A2AR

163.5 ± 14 nM (Ki)

A1AR

503.3 ± 14 nM (Ki)

hA2B

>10000 nM (Ki)

Adenosine A3 receptor

>10000 nM (Ki)

HDAC1

145.3 ± 12 nM (IC50)

HDAC2

240.2 ± 19 nM (IC50)

HDAC3

443.5 ± 27 nM (IC50)

HDAC6

>10000 nM (IC50)

HDAC8

>10000 nM (IC50)

In Vitro

A2AAR/HDAC-IN-1 (compound 14c) (0-100 μM, 72 h) shows anti-proliferative activities against colon cancer cell lines, CT26 and MC38[1].
A2AAR/HDAC-IN-1 (0-5 μM, 24 h) increases histone acetylation[1].
A2AAR/HDAC-IN-1 shows moderate selectivity against A1AR (3-fold) and no significant binding for A2BAR and A3AR[1].

MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Cell Proliferation Assay[1]

Cell Line: Colon cancer cell lines (CT26 and MC38)
Concentration: 0-100 μM
Incubation Time: 72 h
Result: Displayed good cytotoxicity in CT26 and MC38 cells, with GI50 values of 0.29 ± 0.03 μM and 0.38 ± 0.03 μM, respectively.

Western Blot Analysis[1]

Cell Line: MC38 mouse colon cancer cells
Concentration: 0, 0.1, 1, and 5 μM
Incubation Time: 24 h
Result: Increased histone H3 and H4 acetylation in a concentration-dependent manner.
In Vivo

A2AAR/HDAC-IN-1 (compound 14c) (30 or 60 mg/kg, IP, twice daily for 9 days) shows potent anti-tumor effects in the mouse MC38 xenograft model[1].
A2AAR/HDAC-IN-1 (90 mg/kg, bid; 150 mg/kg, qd; Oral gavage, for 15 days) shows weak tumor suppression[1].
A2AAR/HDAC-IN-1 (5 mg/kg, IV; 20 mg/kg PO or IP; once) shows an overall favorable pharmacokinetic profile[1].

MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Animal Model: Male ICR mice (6-8 weeks, ~25 g body weight, MC38 colon cancer model)[1]
Dosage: 30 or 60 mg/kg
Administration: IP, twice daily for 9 days
Result: Significantly inhibited tumor growth at a dosage of 30 mg/kg (ip, bid), with a tumor growth inhibition (TGI) rate of 68%. At a dosage of 60 mg/kg, the TGI rate was further increased to 85%.
Animal Model: Male ICR mice (6-8 weeks, ~25 g body weight, MC38 colon cancer model)[1]
Dosage: 90 mg/kg, bid; 150 mg/kg, qd
Administration: Oral gavage, twice daily (90 mg/kg) or daily (150 mg/kg), for 15 days
Result: Showed only weak tumor suppression even at a dose of 90 mg/kg (po, bid), with inhibition rates of 44%.
Animal Model: Male ICR mice (6-8 weeks, ~25 g body weight)[1]
Dosage: 5 mg/kg (IV) and 20 mg/kg (PO, IP)
Administration: Orally, IP, or IV; once (Pharmacokinetic Analysis)
Result: Pharmacokinetic Parameters of A2AAR/HDAC-IN-1 in male ICR mice[1].
PK Parameters po (20 mg/kg) iv (5 mg/kg) ip (20 mg/kg)
Kel (h-1) 0.390 ± 0.187 1.820 ± 0.300 0.844 ± 0.021
t1/2 (h) 2.24 ± 1.16 0.389 ± 0.070 0.83 ± 0.02
Tmax (h) 0.333 ± 0.14 0.25 ± 0.00
Cmax (ng/mL) 3417 ± 1639 4703 ± 735 8411 ± 693
C0 (ng/mL) 6498 ± 1285
AUC0-t (ng/mL·h) 3602 ± 1807 2098 ± 143 10022 ± 931
CL (mL/min/kg) 39.3 ± 2.3 33.5 ± 3.1
Molecular Weight

439.47

Formula

C24H21N7O2

CAS No.
SMILES

NC1=CC=CC=C1NC(C2=CC=C(C=C2)CCN3N=CC4=C(N=C(N=C43)N)C5=CC=CO5)=O

Shipping

Room temperature in continental US; may vary elsewhere.

Storage

Please store the product under the recommended conditions in the Certificate of Analysis.

Purity & Documentation
References
  • No file chosen (Maximum size is: 1024 Kb)
  • If you have published this work, please enter the PubMed ID.
  • Your name will appear on the site.
  • Molarity Calculator

  • Dilution Calculator

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

Mass   Concentration   Volume   Molecular Weight *
= × ×

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)
× = ×
C1   V1   C2   V2

Your Recently Viewed Products:

Inquiry Online

Your information is safe with us. * Required Fields.

Product Name

 

Salutation

Applicant Name *

 

Email address *

Phone number *

 

Organization name *

Department *

 

Requested quantity *

Country or Region *

     

Remarks

Bulk Inquiry

Inquiry Information

Product Name:
A2AAR/HDAC-IN-1
Cat. No.:
HY-143324
Quantity:
MCE Japan Authorized Agent: