F111-0586 Screening compound: 2-fluoro-N-{2-[2-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}benzamide

F111-0586 Screening compound: 2-fluoro-N-{2-[2-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}benzamide
F111-0586 Screening compound: 2-fluoro-N-{2-[2-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F111-0586
2-fluoro-N-{2-[2-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}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

F111-0586

Molecular Formula

C21H16F2N4O (C21 H16 F2 N4 O)

Compound Name

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

IUPAC name

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

SMILES

O=C(c(cccc1)c1F)NCCn1c(-c(cc2)ccc2F)nc2cccnc12

InChI

InChI=1S/C21H16F2N4O/c22-15-9-7-14(8-10-15)19-26-18-6-3-11-24-20(18)27(19)13-12-25-21(28)16-4-1-2-5-17(16)23/h1-11H,12-13H2,(H,25,28)

InChI Key

DLKYKUOEWVKYPO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27101910

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.38

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

3.974

Distribution Coefficient, logD

3.974

Water Solubility, LogSw

-4.25

Polar Surface Area

44.307

Acid Dissociation Constant (pKa)

12.13

Base Dissociation Constant (pKb)

3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

F111-0586 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with F111-0586 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F111-0586?
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What is the minimum amount of F111-0586 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F111-0586
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F111-0586
  • 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 F111-0586 available by request