F829-0712 Screening compound: 2-(4-fluorophenyl)-5-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4H,5H-pyrazolo[1,5-a]pyrazin-4-one

F829-0712 Screening compound: 2-(4-fluorophenyl)-5-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4H,5H-pyrazolo[1,5-a]pyrazin-4-one
F829-0712 Screening compound: 2-(4-fluorophenyl)-5-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4H,5H-pyrazolo[1,5-a]pyrazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F829-0712
2-(4-fluorophenyl)-5-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-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

F829-0712

Molecular Formula

C24H20FN5O5 (C24 H20 FN5 O5)

Compound Name

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

IUPAC name

2-(4-fluorophenyl)-5-{[3-(345-trimethoxyphenyl)-124-oxadiazol-5-yl]methyl}-4H5H-pyrazolo[15-a]pyrazin-4-one

SMILES

COc1cc(-c2noc(CN(C=Cn(c3c4)nc4-c(cc4)ccc4F)C3=O)n2)cc(OC)c1OC

InChI

InChI=1S/C24H20FN5O5/c1-32-19-10-15(11-20(33-2)22(19)34-3)23-26-21(35-28-23)13-29-8-9-30-18(24(29)31)12-17(27-30)14-4-6-16(25)7-5-14/h4-12H,13H2,1-3H3

InChI Key

CRZBNIMHKJLSCD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27196636

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.923

Distribution Coefficient, logD

2.923

Water Solubility, LogSw

-3.24

Polar Surface Area

82.292

Acid Dissociation Constant (pKa)

31.07

Base Dissociation Constant (pKb)

-2.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

F829-0712 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F829-0712 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F829-0712?
Check Price and Availability of F829-0712, 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 F829-0712 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F829-0712
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F829-0712
  • 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 F829-0712 available by request