E643-0302 Screening compound: 2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-(4-methylphenyl)butanamide

E643-0302 Screening compound: 2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-(4-methylphenyl)butanamide
E643-0302 Screening compound: 2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-(4-methylphenyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-0302
2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)-N-(4-methylphenyl)butanamide

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

E643-0302

Molecular Formula

C24H23FN4OS (C24 H23 FN4 OS)

Compound Name

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

IUPAC name

2-(2-{[(4-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-b]pyridin-3-yl)-N-(4-methylphenyl)butanamide

SMILES

CCC(C(Nc1ccc(C)cc1)=O)n1c(SCc(cc2)ccc2F)nc2c1nccc2

InChI

InChI=1S/C24H23FN4OS/c1-3-21(23(30)27-19-12-6-16(2)7-13-19)29-22-20(5-4-14-26-22)28-24(29)31-15-17-8-10-18(25)11-9-17/h4-14,21H,3,15H2,1-2H3,(H,27,30)/t21-/m0/s1

InChI Key

LQEJHYSLBQIYAM-NRFANRHFSA-N

MDL Number (MFCD)

MFCD14907009

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.021

Distribution Coefficient, logD

5.021

Water Solubility, LogSw

-4.57

Polar Surface Area

44.027

Acid Dissociation Constant (pKa)

11.31

Base Dissociation Constant (pKb)

2.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.80

E643-0302 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with E643-0302 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-0302?
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What is the minimum amount of E643-0302 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-0302
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-0302
  • 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 E643-0302 available by request