P029-0071 Screening compound: 4-[3-(6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]benzonitrile

P029-0071 Screening compound: 4-[3-(6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]benzonitrile
P029-0071 Screening compound: 4-[3-(6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound P029-0071
4-[3-(6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]benzonitrile

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

P029-0071

Molecular Formula

C14H8N4O2 (C14 H8 N4 O2)

Compound Name

4-[3-(6-oxo-1,6-dihydropyridin-3-yl)-1,2,4-oxadiazol-5-yl]benzonitrile

IUPAC name

4-[3-(6-oxo-16-dihydropyridin-3-yl)-124-oxadiazol-5-yl]benzonitrile

SMILES

N#Cc(cc1)ccc1-c1nc(C(C=C2)=CNC2=O)no1

InChI

InChI=1S/C14H8N4O2/c15-7-9-1-3-10(4-2-9)14-17-13(18-20-14)11-5-6-12(19)16-8-11/h1-6,8H,(H,16,19)

InChI Key

GRAGRDHSFMFXHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27559057

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.768

Distribution Coefficient, logD

1.768

Water Solubility, LogSw

-2.12

Polar Surface Area

73.410

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

-2.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

P029-0071 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with P029-0071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P029-0071?
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What is the minimum amount of P029-0071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P029-0071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P029-0071
  • 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 P029-0071 available by request