G831-0290 Screening compound: 2-bromo-N-({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide

G831-0290 Screening compound: 2-bromo-N-({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide
G831-0290 Screening compound: 2-bromo-N-({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G831-0290
2-bromo-N-({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide

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

G831-0290

Molecular Formula

C21H16BrFN4O (C21 H16 BrFN4 O)

Compound Name

2-bromo-N-({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide

IUPAC name

2-bromo-N-({3-[(4-fluorophenyl)methyl]-3H-imidazo[45-b]pyridin-2-yl}methyl)benzamide

SMILES

O=C(c(cccc1)c1Br)NCc(n1Cc(cc2)ccc2F)nc2c1nccc2

InChI

InChI=1S/C21H16BrFN4O/c22-17-5-2-1-4-16(17)21(28)25-12-19-26-18-6-3-11-24-20(18)27(19)13-14-7-9-15(23)10-8-14/h1-11H,12-13H2,(H,25,28)

InChI Key

VVQXAEWDYIVBBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27163897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.995

Distribution Coefficient, logD

3.992

Water Solubility, LogSw

-4.40

Polar Surface Area

45.463

Acid Dissociation Constant (pKa)

9.62

Base Dissociation Constant (pKb)

3.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

G831-0290 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with G831-0290 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G831-0290?
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What is the minimum amount of G831-0290 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G831-0290
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G831-0290
  • 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 G831-0290 available by request