G831-0291 Screening compound: 4-(dimethylamino)-N-({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide

G831-0291 Screening compound: 4-(dimethylamino)-N-({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide
G831-0291 Screening compound: 4-(dimethylamino)-N-({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G831-0291
4-(dimethylamino)-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

G831-0291

Molecular Formula

C23H22FN5O (C23 H22 FN5 O)

Compound Name

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

IUPAC name

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

SMILES

CN(C)c(cc1)ccc1C(NCc1nc2cccnc2n1Cc(cc1)ccc1F)=O

InChI

InChI=1S/C23H22FN5O/c1-28(2)19-11-7-17(8-12-19)23(30)26-14-21-27-20-4-3-13-25-22(20)29(21)15-16-5-9-18(24)10-6-16/h3-13H,14-15H2,1-2H3,(H,26,30)

InChI Key

FXWKCOIAPFOZCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27163898

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.478

Distribution Coefficient, logD

3.477

Water Solubility, LogSw

-3.65

Polar Surface Area

48.268

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

3.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

G831-0291 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

CNS Targets (44014 compounds)

Immunological Library (6760 compounds)

Epigenetics Focused Set (26518 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with G831-0291 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G831-0291?
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What is the minimum amount of G831-0291 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G831-0291
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G831-0291
  • 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 G831-0291 available by request