8020-0224 Screening compound: 7-(3-chlorophenyl)-3-[3-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H-imidazo[4,5-b]pyridin-5-one

8020-0224 Screening compound: 7-(3-chlorophenyl)-3-[3-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H-imidazo[4,5-b]pyridin-5-one
8020-0224 Screening compound: 7-(3-chlorophenyl)-3-[3-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H-imidazo[4,5-b]pyridin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-0224
7-(3-chlorophenyl)-3-[3-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H-imidazo[4,5-b]pyridin-5-one

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

8020-0224

Molecular Formula

C19H13ClF3N3O (C19 H13 ClF3 N3 O)

Compound Name

7-(3-chlorophenyl)-3-[3-(trifluoromethyl)phenyl]-3H,4H,5H,6H,7H-imidazo[4,5-b]pyridin-5-one

IUPAC name

7-(3-chlorophenyl)-3-[3-(trifluoromethyl)phenyl]-3H4H5H6H7H-imidazo[45-b]pyridin-5-one

SMILES

O=C(CC1c2cccc(Cl)c2)Nc2c1ncn2-c1cc(C(F)(F)F)ccc1

InChI

InChI=1S/C19H13ClF3N3O/c20-13-5-1-3-11(7-13)15-9-16(27)25-18-17(15)24-10-26(18)14-6-2-4-12(8-14)19(21,22)23/h1-8,10,15H,9H2,(H,25,27)/t15-/m1/s1

InChI Key

IBJYJIHXDZUWGP-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD12034655

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.78

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.705

Distribution Coefficient, logD

4.703

Water Solubility, LogSw

-5.01

Polar Surface Area

36.689

Acid Dissociation Constant (pKa)

13.00

Base Dissociation Constant (pKb)

5.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.80

8020-0224 in Drug Discovery

Included in Screening Libraries

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

Ion Channels Focused Library (26372 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8020-0224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-0224?
Check Price and Availability of 8020-0224, 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 8020-0224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-0224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-0224
  • 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 8020-0224 available by request