G812-2131 Screening compound: N-cyclooctyl-4-{3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}butanamide

G812-2131 Screening compound: N-cyclooctyl-4-{3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}butanamide
G812-2131 Screening compound: N-cyclooctyl-4-{3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G812-2131
N-cyclooctyl-4-{3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}butanamide

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

G812-2131

Molecular Formula

C25H31FN4O (C25 H31 FN4 O)

Compound Name

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

IUPAC name

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

SMILES

O=C(CCCc1nc2cccnc2n1Cc(cc1)ccc1F)NC1CCCCCCC1

InChI

InChI=1S/C25H31FN4O/c26-20-15-13-19(14-16-20)18-30-23(29-22-10-7-17-27-25(22)30)11-6-12-24(31)28-21-8-4-2-1-3-5-9-21/h7,10,13-17,21H,1-6,8-9,11-12,18H2,(H,28,31)

InChI Key

QEFQOUKNVDTPBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15038562

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.854

Distribution Coefficient, logD

4.854

Water Solubility, LogSw

-4.83

Polar Surface Area

45.306

Acid Dissociation Constant (pKa)

14.82

Base Dissociation Constant (pKb)

4.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

G812-2131 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Epigenetics Focused Set (26518 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with G812-2131 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G812-2131?
Check Price and Availability of G812-2131, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G812-2131 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G812-2131
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G812-2131
  • 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 G812-2131 available by request