F112-0049 Screening compound: N-{2-[2-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}-3,4-dimethylbenzene-1-sulfonamide

F112-0049 Screening compound: N-{2-[2-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}-3,4-dimethylbenzene-1-sulfonamide
F112-0049 Screening compound: N-{2-[2-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}-3,4-dimethylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F112-0049
N-{2-[2-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}-3,4-dimethylbenzene-1-sulfonamide

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

F112-0049

Molecular Formula

C22H21FN4O2S (C22 H21 FN4 O2 S)

Compound Name

N-{2-[2-(4-fluorophenyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}-3,4-dimethylbenzene-1-sulfonamide

IUPAC name

N-{2-[2-(4-fluorophenyl)-3H-imidazo[45-b]pyridin-3-yl]ethyl}-34-dimethylbenzene-1-sulfonamide

SMILES

Cc(cc1)c(C)cc1S(NCCn1c(-c(cc2)ccc2F)nc2cccnc12)(=O)=O

InChI

InChI=1S/C22H21FN4O2S/c1-15-5-10-19(14-16(15)2)30(28,29)25-12-13-27-21(17-6-8-18(23)9-7-17)26-20-4-3-11-24-22(20)27/h3-11,14,25H,12-13H2,1-2H3

InChI Key

GGTFIZBOIZRMCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14941507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.022

Distribution Coefficient, logD

5.021

Water Solubility, LogSw

-4.64

Polar Surface Area

61.652

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

4.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

F112-0049 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F112-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F112-0049?
Check Price and Availability of F112-0049, 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 F112-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F112-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F112-0049
  • 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 F112-0049 available by request