E643-1013 Screening compound: N-(2,5-dimethylphenyl)-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)acetamide

E643-1013 Screening compound: N-(2,5-dimethylphenyl)-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)acetamide
E643-1013 Screening compound: N-(2,5-dimethylphenyl)-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-1013
N-(2,5-dimethylphenyl)-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)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

E643-1013

Molecular Formula

C23H21FN4OS (C23 H21 FN4 OS)

Compound Name

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

IUPAC name

N-(25-dimethylphenyl)-2-(2-{[(2-fluorophenyl)methyl]sulfanyl}-3H-imidazo[45-b]pyridin-3-yl)acetamide

SMILES

Cc1cc(NC(Cn2c(SCc(cccc3)c3F)nc3c2nccc3)=O)c(C)cc1

InChI

InChI=1S/C23H21FN4OS/c1-15-9-10-16(2)20(12-15)26-21(29)13-28-22-19(8-5-11-25-22)27-23(28)30-14-17-6-3-4-7-18(17)24/h3-12H,13-14H2,1-2H3,(H,26,29)

InChI Key

BZPDKNJQQSRFNE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14907156

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.721

Distribution Coefficient, logD

4.721

Water Solubility, LogSw

-4.43

Polar Surface Area

42.836

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

2.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

E643-1013 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 E643-1013 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-1013?
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What is the minimum amount of E643-1013 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-1013
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-1013
  • 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 E643-1013 available by request