E643-1179 Screening compound: 2-(2-chlorophenyl)-5-methyl-4-{[2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}-1,3-oxazole

E643-1179 Screening compound: 2-(2-chlorophenyl)-5-methyl-4-{[2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}-1,3-oxazole
E643-1179 Screening compound: 2-(2-chlorophenyl)-5-methyl-4-{[2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-1179
2-(2-chlorophenyl)-5-methyl-4-{[2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}-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

E643-1179

Molecular Formula

C25H18ClF3N4OS (C25 H18 ClF3 N4 OS)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(Cn2c(SCc3cc(C(F)(F)F)ccc3)nc3cccnc23)nc(-c(cccc2)c2Cl)o1

InChI

InChI=1S/C25H18ClF3N4OS/c1-15-21(31-23(34-15)18-8-2-3-9-19(18)26)13-33-22-20(10-5-11-30-22)32-24(33)35-14-16-6-4-7-17(12-16)25(27,28)29/h2-12H,13-14H2,1H3

InChI Key

FBOOAGTXRXLJRN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14907212

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.96

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.513

Distribution Coefficient, logD

6.502

Water Solubility, LogSw

-6.24

Polar Surface Area

38.506

Acid Dissociation Constant (pKa)

21.84

Base Dissociation Constant (pKb)

6.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

E643-1179 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 E643-1179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-1179?
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What is the minimum amount of E643-1179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-1179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-1179
  • 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 E643-1179 available by request