J022-0861 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-6-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-amine

J022-0861 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-6-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-amine
J022-0861 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-6-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound J022-0861
N-(2H-1,3-benzodioxol-5-yl)-6-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-amine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

J022-0861

Molecular Formula

C20H15BrN4O3 (C20 H15 BrN4 O3)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-6-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-amine

IUPAC name

N-(2H-13-benzodioxol-5-yl)-6-bromo-2-(4-methoxyphenyl)imidazo[12-a]pyrazin-3-amine

SMILES

COc(cc1)ccc1-c1c(Nc(cc2)cc3c2OCO3)n(cc(nc2)Br)c2n1

InChI

InChI=1S/C20H15BrN4O3/c1-26-14-5-2-12(3-6-14)19-20(25-10-17(21)22-9-18(25)24-19)23-13-4-7-15-16(8-13)28-11-27-15/h2-10,23H,11H2,1H3

InChI Key

HJXJYEOVMLZEQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27644405

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.410

Distribution Coefficient, logD

4.410

Water Solubility, LogSw

-4.30

Polar Surface Area

51.719

Acid Dissociation Constant (pKa)

18.75

Base Dissociation Constant (pKb)

3.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

J022-0861 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with J022-0861 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J022-0861?
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What is the minimum amount of J022-0861 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J022-0861
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J022-0861
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of J022-0861 available by request