E643-0017 Screening compound: 2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridine

E643-0017 Screening compound: 2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridine
E643-0017 Screening compound: 2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-0017
2-{[(3-methylphenyl)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

E643-0017

Molecular Formula

C14H13N3S (C14 H13 N3 S)

Compound Name

2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridine

IUPAC name

2-{[(3-methylphenyl)methyl]sulfanyl}-3H-imidazo[45-b]pyridine

SMILES

Cc1cccc(CSc([nH]2)nc3c2nccc3)c1

InChI

InChI=1S/C14H13N3S/c1-10-4-2-5-11(8-10)9-18-14-16-12-6-3-7-15-13(12)17-14/h2-8H,9H2,1H3,(H,15,16,17)

InChI Key

XHXISUQBHHTIGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05691717

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

255.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.223

Distribution Coefficient, logD

3.215

Water Solubility, LogSw

-3.04

Polar Surface Area

28.354

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

3.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

E643-0017 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E643-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-0017?
Check Price and Availability of E643-0017, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E643-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-0017
  • 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 E643-0017 available by request