C488-1463 Screening compound: 4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-chloroimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol

C488-1463 Screening compound: 4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-chloroimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol
C488-1463 Screening compound: 4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-chloroimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound C488-1463
4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-chloroimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol

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

C488-1463

Molecular Formula

C21H16ClN3O4 (C21 H16 ClN3 O4)

Compound Name

4-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-chloroimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol

IUPAC name

4-{3-[(2H-13-benzodioxol-5-yl)amino]-6-chloroimidazo[12-a]pyridin-2-yl}-2-methoxyphenol

SMILES

COc(cc(cc1)-c2c(Nc(cc3)cc4c3OCO4)n(cc(cc3)Cl)c3n2)c1O

InChI

InChI=1S/C21H16ClN3O4/c1-27-17-8-12(2-5-15(17)26)20-21(25-10-13(22)3-7-19(25)24-20)23-14-4-6-16-18(9-14)29-11-28-16/h2-10,23,26H,11H2,1H3

InChI Key

SFCXFZCZBLZQHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08682683

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.548

Distribution Coefficient, logD

4.477

Water Solubility, LogSw

-4.51

Polar Surface Area

58.866

Acid Dissociation Constant (pKa)

8.99

Base Dissociation Constant (pKb)

6.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

C488-1463 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Carbonic Anhydrase II Library (4939 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C488-1463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C488-1463?
Check Price and Availability of C488-1463, 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 C488-1463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C488-1463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C488-1463
  • 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 C488-1463 available by request