E643-1202 Screening compound: 3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine

E643-1202 Screening compound: 3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine
E643-1202 Screening compound: 3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-1202
3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine

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

E643-1202

Molecular Formula

C21H14ClF4N3S (C21 H14 ClF4 N3 S)

Compound Name

3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[4,5-b]pyridine

IUPAC name

3-[(2-chloro-4-fluorophenyl)methyl]-2-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-3H-imidazo[45-b]pyridine

SMILES

FC(c1cccc(CSc2nc3cccnc3n2Cc(ccc(F)c2)c2Cl)c1)(F)F

InChI

InChI=1S/C21H14ClF4N3S/c22-17-10-16(23)7-6-14(17)11-29-19-18(5-2-8-27-19)28-20(29)30-12-13-3-1-4-15(9-13)21(24,25)26/h1-10H,11-12H2

InChI Key

OWAYHKPLRJGYFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14907221

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

451.87

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.425

Distribution Coefficient, logD

6.424

Water Solubility, LogSw

-6.79

Polar Surface Area

20.384

Acid Dissociation Constant (pKa)

18.81

Base Dissociation Constant (pKb)

4.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

E643-1202 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 E643-1202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-1202?
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What is the minimum amount of E643-1202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-1202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-1202
  • 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 E643-1202 available by request