F829-0711 Screening compound: 5-{[3-(3-bromo-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(4-fluorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-4-one

F829-0711 Screening compound: 5-{[3-(3-bromo-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(4-fluorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-4-one
F829-0711 Screening compound: 5-{[3-(3-bromo-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(4-fluorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F829-0711
5-{[3-(3-bromo-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(4-fluorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-4-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

F829-0711

Molecular Formula

C21H12BrF2N5O2 (C21 H12 BrF2 N5 O2)

Compound Name

5-{[3-(3-bromo-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(4-fluorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-4-one

IUPAC name

5-{[3-(3-bromo-4-fluorophenyl)-124-oxadiazol-5-yl]methyl}-2-(4-fluorophenyl)-4H5H-pyrazolo[15-a]pyrazin-4-one

SMILES

O=C(c1c2)N(Cc3nc(-c(cc4)cc(Br)c4F)no3)C=Cn1nc2-c(cc1)ccc1F

InChI

InChI=1S/C21H12BrF2N5O2/c22-15-9-13(3-6-16(15)24)20-25-19(31-27-20)11-28-7-8-29-18(21(28)30)10-17(26-29)12-1-4-14(23)5-2-12/h1-10H,11H2

InChI Key

BOUZBSSFNNLJLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27196635

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.299

Distribution Coefficient, logD

4.299

Water Solubility, LogSw

-4.51

Polar Surface Area

59.314

Acid Dissociation Constant (pKa)

31.07

Base Dissociation Constant (pKb)

-2.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

F829-0711 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

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

Immunological Library (6760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Immune system

References: we are preparing a list of scientific research reports with F829-0711 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F829-0711?
Check Price and Availability of F829-0711, 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 F829-0711 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F829-0711
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F829-0711
  • 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 F829-0711 available by request