5408-2625 Screening compound: 2-ethoxy-4-{3-[(E)-{[4-(methylsulfanyl)phenyl]methylidene}amino]imidazo[1,2-a]pyridin-2-yl}phenol

5408-2625 Screening compound: 2-ethoxy-4-{3-[(E)-{[4-(methylsulfanyl)phenyl]methylidene}amino]imidazo[1,2-a]pyridin-2-yl}phenol
5408-2625 Screening compound: 2-ethoxy-4-{3-[(E)-{[4-(methylsulfanyl)phenyl]methylidene}amino]imidazo[1,2-a]pyridin-2-yl}phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 5408-2625
2-ethoxy-4-{3-[(E)-{[4-(methylsulfanyl)phenyl]methylidene}amino]imidazo[1,2-a]pyridin-2-yl}phenol

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

5408-2625

Molecular Formula

C23H21N3O2S (C23 H21 N3 O2 S)

Compound Name

2-ethoxy-4-{3-[(E)-{[4-(methylsulfanyl)phenyl]methylidene}amino]imidazo[1,2-a]pyridin-2-yl}phenol

IUPAC name

2-ethoxy-4-{3-[(E)-{[4-(methylsulfanyl)phenyl]methylidene}amino]imidazo[12-a]pyridin-2-yl}phenol

SMILES

CCOc(cc(cc1)-c(nc2n3cccc2)c3/N=C/c(cc2)ccc2SC)c1O

InChI

InChI=1S/C23H21N3O2S/c1-3-28-20-14-17(9-12-19(20)27)22-23(26-13-5-4-6-21(26)25-22)24-15-16-7-10-18(29-2)11-8-16/h4-15,27H,3H2,1-2H3

InChI Key

RDPKDSMZEWXERV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01648820

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.762

Distribution Coefficient, logD

4.751

Water Solubility, LogSw

-4.24

Polar Surface Area

40.652

Acid Dissociation Constant (pKa)

9.27

Base Dissociation Constant (pKb)

5.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

5408-2625 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 5408-2625 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5408-2625?
Check Price and Availability of 5408-2625, 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 5408-2625 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5408-2625
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5408-2625
  • 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 5408-2625 available by request