E642-0692 Screening compound: N-(3-ethoxypropyl)-4-[({3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzamide

E642-0692 Screening compound: N-(3-ethoxypropyl)-4-[({3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzamide
E642-0692 Screening compound: N-(3-ethoxypropyl)-4-[({3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E642-0692
N-(3-ethoxypropyl)-4-[({3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]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

E642-0692

Molecular Formula

C27H30N4O3S (C27 H30 N4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCOCCCNC(c1ccc(CSc(n2Cc(cc3)ccc3OC)nc3c2nccc3)cc1)=O

InChI

InChI=1S/C27H30N4O3S/c1-3-34-17-5-16-29-26(32)22-11-7-21(8-12-22)19-35-27-30-24-6-4-15-28-25(24)31(27)18-20-9-13-23(33-2)14-10-20/h4,6-15H,3,5,16-19H2,1-2H3,(H,29,32)

InChI Key

OGEKNTBSLDWLRG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14906707

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.63

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.004

Distribution Coefficient, logD

4.003

Water Solubility, LogSw

-4.00

Polar Surface Area

60.432

Acid Dissociation Constant (pKa)

14.11

Base Dissociation Constant (pKb)

4.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

E642-0692 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E642-0692 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E642-0692?
Check Price and Availability of E642-0692, 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 E642-0692 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E642-0692
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E642-0692
  • 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 E642-0692 available by request