CM4721-6851 Screening compound: 2-(5-{4-FLUORO-1-[(3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL}-1,2,4-OXADIAZOL-3-YL)PYRAZINE

CM4721-6851 Screening compound: 2-(5-{4-FLUORO-1-[(3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL}-1,2,4-OXADIAZOL-3-YL)PYRAZINE
CM4721-6851 Screening compound: 2-(5-{4-FLUORO-1-[(3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL}-1,2,4-OXADIAZOL-3-YL)PYRAZINE alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4721-6851
2-(5-{4-FLUORO-1-[(3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL}-1,2,4-OXADIAZOL-3-YL)PYRAZINE

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

CM4721-6851

Molecular Formula

C19H20FN5O2 (C19 H20 FN5 O2)

Compound Name

2-(5-{4-FLUORO-1-[(3-METHOXYPHENYL)METHYL]PIPERIDIN-4-YL}-1,2,4-OXADIAZOL-3-YL)PYRAZINE

IUPAC name

2-(5-{4-fluoro-1-[(3-methoxyphenyl)methyl]piperidin-4-yl}-124-oxadiazol-3-yl)pyrazine

SMILES

COc1cccc(CN(CC2)CCC2(c2nc(-c3nccnc3)no2)F)c1

InChI

InChI=1S/C19H20FN5O2/c1-26-15-4-2-3-14(11-15)13-25-9-5-19(20,6-10-25)18-23-17(24-27-18)16-12-21-7-8-22-16/h2-4,7-8,11-12H,5-6,9-10,13H2,1H3

InChI Key

FVSYWAQWCQDUAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30465217

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.527

Distribution Coefficient, logD

0.417

Water Solubility, LogSw

-2.25

Polar Surface Area

61.486

Acid Dissociation Constant (pKa)

27.43

Base Dissociation Constant (pKb)

9.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.84

CM4721-6851 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with CM4721-6851 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4721-6851?
Check Price and Availability of CM4721-6851, 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 CM4721-6851 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4721-6851
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4721-6851
  • 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 CM4721-6851 available by request