F112-0585 Screening compound: 2,5-dimethyl-N-{2-[2-(pyridin-4-yl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}benzene-1-sulfonamide

F112-0585 Screening compound: 2,5-dimethyl-N-{2-[2-(pyridin-4-yl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}benzene-1-sulfonamide
F112-0585 Screening compound: 2,5-dimethyl-N-{2-[2-(pyridin-4-yl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F112-0585
2,5-dimethyl-N-{2-[2-(pyridin-4-yl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}benzene-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

F112-0585

Molecular Formula

C21H21N5O2S (C21 H21 N5 O2 S)

Compound Name

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

IUPAC name

25-dimethyl-N-{2-[2-(pyridin-4-yl)-3H-imidazo[45-b]pyridin-3-yl]ethyl}benzene-1-sulfonamide

SMILES

Cc1cc(S(NCCn2c(-c3ccncc3)nc3cccnc23)(=O)=O)c(C)cc1

InChI

InChI=1S/C21H21N5O2S/c1-15-5-6-16(2)19(14-15)29(27,28)24-12-13-26-20(17-7-10-22-11-8-17)25-18-4-3-9-23-21(18)26/h3-11,14,24H,12-13H2,1-2H3

InChI Key

WRMBSUCGQLQZSN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27102049

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.546

Distribution Coefficient, logD

3.545

Water Solubility, LogSw

-3.55

Polar Surface Area

71.080

Acid Dissociation Constant (pKa)

11.33

Base Dissociation Constant (pKb)

4.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

F112-0585 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 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 F112-0585 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F112-0585?
Check Price and Availability of F112-0585, 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 F112-0585 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F112-0585
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F112-0585
  • 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 F112-0585 available by request