E643-0049 Screening compound: 2-(3,4-dimethoxyphenyl)-4-({3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}methyl)-5-methyl-1,3-oxazole

E643-0049 Screening compound: 2-(3,4-dimethoxyphenyl)-4-({3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}methyl)-5-methyl-1,3-oxazole
E643-0049 Screening compound: 2-(3,4-dimethoxyphenyl)-4-({3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}methyl)-5-methyl-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-0049
2-(3,4-dimethoxyphenyl)-4-({3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}methyl)-5-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

E643-0049

Molecular Formula

C19H18N4O3S (C19 H18 N4 O3 S)

Compound Name

2-(3,4-dimethoxyphenyl)-4-({3H-imidazo[4,5-b]pyridin-2-ylsulfanyl}methyl)-5-methyl-1,3-oxazole

IUPAC name

2-(34-dimethoxyphenyl)-4-({3H-imidazo[45-b]pyridin-2-ylsulfanyl}methyl)-5-methyl-13-oxazole

SMILES

Cc1c(CSc([nH]2)nc3c2nccc3)nc(-c(cc2)cc(OC)c2OC)o1

InChI

InChI=1S/C19H18N4O3S/c1-11-14(10-27-19-22-13-5-4-8-20-17(13)23-19)21-18(26-11)12-6-7-15(24-2)16(9-12)25-3/h4-9H,10H2,1-3H3,(H,20,22,23)

InChI Key

DIUCJXXWPUYJAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14906902

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.753

Distribution Coefficient, logD

2.743

Water Solubility, LogSw

-3.02

Polar Surface Area

61.737

Acid Dissociation Constant (pKa)

11.56

Base Dissociation Constant (pKb)

5.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

E643-0049 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Antimitotic Tubulin Library (17355 compounds)

CNS Targets (44014 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E643-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-0049?
Check Price and Availability of E643-0049, 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 E643-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-0049
  • 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 E643-0049 available by request