E643-0361 Screening compound: 2-(3,4-dimethoxyphenyl)-5-methyl-4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-1,3-oxazole

E643-0361 Screening compound: 2-(3,4-dimethoxyphenyl)-5-methyl-4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-1,3-oxazole
E643-0361 Screening compound: 2-(3,4-dimethoxyphenyl)-5-methyl-4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)methyl]-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound E643-0361
2-(3,4-dimethoxyphenyl)-5-methyl-4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-b]pyridin-3-yl)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

E643-0361

Molecular Formula

C27H26N4O3S (C27 H26 N4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(Cn2c(SCc3ccc(C)cc3)nc3c2nccc3)nc(-c(cc2)cc(OC)c2OC)o1

InChI

InChI=1S/C27H26N4O3S/c1-17-7-9-19(10-8-17)16-35-27-30-21-6-5-13-28-25(21)31(27)15-22-18(2)34-26(29-22)20-11-12-23(32-3)24(14-20)33-4/h5-14H,15-16H2,1-4H3

InChI Key

AQJJJYFATZTGHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14907024

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.040

Distribution Coefficient, logD

5.029

Water Solubility, LogSw

-4.76

Polar Surface Area

53.767

Acid Dissociation Constant (pKa)

22.22

Base Dissociation Constant (pKb)

6.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

E643-0361 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Human Kinases Annotated Library (2415 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E643-0361 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E643-0361?
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What is the minimum amount of E643-0361 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E643-0361
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E643-0361
  • 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 E643-0361 available by request