E642-0183 Screening compound: 4-[({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide

E642-0183 Screening compound: 4-[({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide
E642-0183 Screening compound: 4-[({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E642-0183
4-[({3-[(4-fluorophenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]-N-(2-methoxyethyl)benzamide

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

E642-0183

Molecular Formula

C24H23FN4O2S (C24 H23 FN4 O2 S)

Compound Name

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

IUPAC name

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

SMILES

COCCNC(c1ccc(CSc(n2Cc(cc3)ccc3F)nc3c2nccc3)cc1)=O

InChI

InChI=1S/C24H23FN4O2S/c1-31-14-13-27-23(30)19-8-4-18(5-9-19)16-32-24-28-21-3-2-12-26-22(21)29(24)15-17-6-10-20(25)11-7-17/h2-12H,13-16H2,1H3,(H,27,30)

InChI Key

WTYVDVZWZLMJOO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14906615

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.547

Distribution Coefficient, logD

3.546

Water Solubility, LogSw

-3.71

Polar Surface Area

53.253

Acid Dissociation Constant (pKa)

13.05

Base Dissociation Constant (pKb)

4.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

E642-0183 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Epigenetics Focused Set (26518 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with E642-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E642-0183?
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What is the minimum amount of E642-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E642-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E642-0183
  • 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 E642-0183 available by request