J065-0425 Screening compound: N-(4-carbamoylphenyl)-1-{[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperidine-4-carboxamide

J065-0425 Screening compound: N-(4-carbamoylphenyl)-1-{[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperidine-4-carboxamide
J065-0425 Screening compound: N-(4-carbamoylphenyl)-1-{[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J065-0425
N-(4-carbamoylphenyl)-1-{[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperidine-4-carboxamide

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

J065-0425

Molecular Formula

C22H22FN5O3 (C22 H22 FN5 O3)

Compound Name

N-(4-carbamoylphenyl)-1-{[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperidine-4-carboxamide

IUPAC name

N-(4-carbamoylphenyl)-1-{[5-(4-fluorophenyl)-124-oxadiazol-3-yl]methyl}piperidine-4-carboxamide

SMILES

NC(c(cc1)ccc1NC(C1CCN(Cc2noc(-c(cc3)ccc3F)n2)CC1)=O)=O

InChI

InChI=1S/C22H22FN5O3/c23-17-5-1-16(2-6-17)22-26-19(27-31-22)13-28-11-9-15(10-12-28)21(30)25-18-7-3-14(4-8-18)20(24)29/h1-8,15H,9-13H2,(H2,24,29)(H,25,30)

InChI Key

AQMRGLUGXXRHQR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27223235

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.756

Distribution Coefficient, logD

1.739

Water Solubility, LogSw

-2.35

Polar Surface Area

93.789

Acid Dissociation Constant (pKa)

9.88

Base Dissociation Constant (pKb)

5.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

J065-0425 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Immune system
  • animal
Targets:
  • GPCR
  • Ion Channels
  • Kinases

References: we are preparing a list of scientific research reports with J065-0425 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J065-0425?
Check Price and Availability of J065-0425, 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 J065-0425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J065-0425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J065-0425
  • 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 J065-0425 available by request