E643-0843 Screening compound: 4-[(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-5-methyl-2-(thiophen-2-yl)-1,3-oxazole

E643-0843 Screening compound: 4-[(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-5-methyl-2-(thiophen-2-yl)-1,3-oxazole
E643-0843 Screening compound: 4-[(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-5-methyl-2-(thiophen-2-yl)-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-0843
4-[(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-5-methyl-2-(thiophen-2-yl)-1,3-oxazole

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

E643-0843

Molecular Formula

C22H17FN4OS2 (C22 H17 FN4 OS2)

Compound Name

4-[(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-5-methyl-2-(thiophen-2-yl)-1,3-oxazole

IUPAC name

4-[(2-{[(3-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-b]pyridin-3-yl)methyl]-5-methyl-2-(thiophen-2-yl)-13-oxazole

SMILES

Cc1c(Cn2c(SCc3cc(F)ccc3)nc3cccnc23)nc(-c2cccs2)o1

InChI

InChI=1S/C22H17FN4OS2/c1-14-18(25-21(28-14)19-8-4-10-29-19)12-27-20-17(7-3-9-24-20)26-22(27)30-13-15-5-2-6-16(23)11-15/h2-11H,12-13H2,1H3

InChI Key

SFBQVZFBSOJSEV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14907092

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.314

Distribution Coefficient, logD

5.303

Water Solubility, LogSw

-5.42

Polar Surface Area

39.524

Acid Dissociation Constant (pKa)

22.16

Base Dissociation Constant (pKb)

6.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

E643-0843 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epigenetics Focused Set (26518 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with E643-0843 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-0843?
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What is the minimum amount of E643-0843 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-0843
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-0843
  • 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 E643-0843 available by request