F829-0316 Screening compound: 2-(4-chlorophenyl)-5-{[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-4H,5H-pyrazolo[1,5-a]pyrazin-4-one

F829-0316 Screening compound: 2-(4-chlorophenyl)-5-{[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-4H,5H-pyrazolo[1,5-a]pyrazin-4-one
F829-0316 Screening compound: 2-(4-chlorophenyl)-5-{[3-(3-fluorophenyl)-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 F829-0316
2-(4-chlorophenyl)-5-{[3-(3-fluorophenyl)-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

F829-0316

Molecular Formula

C21H13ClFN5O2 (C21 H13 ClFN5 O2)

Compound Name

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

IUPAC name

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

SMILES

O=C(c1c2)N(Cc3nc(-c4cc(F)ccc4)no3)C=Cn1nc2-c(cc1)ccc1Cl

InChI

InChI=1S/C21H13ClFN5O2/c22-15-6-4-13(5-7-15)17-11-18-21(29)27(8-9-28(18)25-17)12-19-24-20(26-30-19)14-2-1-3-16(23)10-14/h1-11H,12H2

InChI Key

IJIRJUDNBPRVFT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27196598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.82

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

4.128

Distribution Coefficient, logD

4.128

Water Solubility, LogSw

-4.61

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

References: we are preparing a list of scientific research reports with F829-0316 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F829-0316?
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What is the minimum amount of F829-0316 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F829-0316
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F829-0316
  • 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 F829-0316 available by request