E643-0824 Screening compound: 2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]acetamide

E643-0824 Screening compound: 2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]acetamide
E643-0824 Screening compound: 2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-0824
2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]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

E643-0824

Molecular Formula

C22H19FN4OS2 (C22 H19 FN4 OS2)

Compound Name

2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]acetamide

IUPAC name

2-(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-b]pyridin-3-yl)-N-[3-(methylsulfanyl)phenyl]acetamide

SMILES

CSc1cccc(NC(Cn2c(SCc3cc(F)ccc3)nc3c2nccc3)=O)c1

InChI

InChI=1S/C22H19FN4OS2/c1-29-18-8-3-7-17(12-18)25-20(28)13-27-21-19(9-4-10-24-21)26-22(27)30-14-15-5-2-6-16(23)11-15/h2-12H,13-14H2,1H3,(H,25,28)

InChI Key

HFNBNLMNFKNWBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14907081

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

438.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.976

Distribution Coefficient, logD

4.976

Water Solubility, LogSw

-4.68

Polar Surface Area

43.533

Acid Dissociation Constant (pKa)

12.26

Base Dissociation Constant (pKb)

3.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

E643-0824 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E643-0824 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-0824?
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What is the minimum amount of E643-0824 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-0824
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-0824
  • 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 E643-0824 available by request