E643-0094 Screening compound: N-(3-chloro-4-fluorophenyl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}acetamide

E643-0094 Screening compound: N-(3-chloro-4-fluorophenyl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}acetamide
E643-0094 Screening compound: N-(3-chloro-4-fluorophenyl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-0094
N-(3-chloro-4-fluorophenyl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}acetamide

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

E643-0094

Molecular Formula

C14H10ClFN4OS (C14 H10 ClFN4 OS)

Compound Name

N-(3-chloro-4-fluorophenyl)-2-{3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}acetamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-2-{3H-imidazo[45-b]pyridin-2-ylsulfanyl}acetamide

SMILES

O=C(CSc([nH]1)nc2c1nccc2)Nc(cc1)cc(Cl)c1F

InChI

InChI=1S/C14H10ClFN4OS/c15-9-6-8(3-4-10(9)16)18-12(21)7-22-14-19-11-2-1-5-17-13(11)20-14/h1-6H,7H2,(H,18,21)(H,17,19,20)

InChI Key

NCIHJZCEISSIQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05702954

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.78

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.705

Distribution Coefficient, logD

2.697

Water Solubility, LogSw

-3.42

Polar Surface Area

51.503

Acid Dissociation Constant (pKa)

9.15

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

E643-0094 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Aging Library (44940 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with E643-0094 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-0094?
Check Price and Availability of E643-0094, 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 E643-0094 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-0094
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-0094
  • 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 E643-0094 available by request