J022-0864 Screening compound: 4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-bromoimidazo[1,2-a]pyrazin-2-yl}-2-methoxyphenol

J022-0864 Screening compound: 4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-bromoimidazo[1,2-a]pyrazin-2-yl}-2-methoxyphenol
J022-0864 Screening compound: 4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-bromoimidazo[1,2-a]pyrazin-2-yl}-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound J022-0864
4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-bromoimidazo[1,2-a]pyrazin-2-yl}-2-methoxyphenol

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

J022-0864

Molecular Formula

C20H15BrN4O4 (C20 H15 BrN4 O4)

Compound Name

4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-bromoimidazo[1,2-a]pyrazin-2-yl}-2-methoxyphenol

IUPAC name

4-{3-[(2H-13-benzodioxol-5-yl)amino]-6-bromoimidazo[12-a]pyrazin-2-yl}-2-methoxyphenol

SMILES

COc(cc(cc1)-c2c(Nc(cc3)cc4c3OCO4)n(cc(nc3)Br)c3n2)c1O

InChI

InChI=1S/C20H15BrN4O4/c1-27-15-6-11(2-4-13(15)26)19-20(25-9-17(21)22-8-18(25)24-19)23-12-3-5-14-16(7-12)29-10-28-14/h2-9,23,26H,10H2,1H3

InChI Key

HMMRJLZNZOLRID-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27218919

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.722

Distribution Coefficient, logD

3.709

Water Solubility, LogSw

-3.65

Polar Surface Area

68.353

Acid Dissociation Constant (pKa)

8.99

Base Dissociation Constant (pKb)

5.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

J022-0864 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Hsp90-Targeted Library (11355 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Carbonic Anhydrase II Library (4939 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with J022-0864 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J022-0864?
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What is the minimum amount of J022-0864 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J022-0864
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J022-0864
  • 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 J022-0864 available by request