P616-0067 Screening compound: N-[3-(3-{[1,2,4]triazolo[4,3-a]pyridin-6-yl}-1,2,4-oxadiazol-5-yl)phenyl]acetamide

P616-0067 Screening compound: N-[3-(3-{[1,2,4]triazolo[4,3-a]pyridin-6-yl}-1,2,4-oxadiazol-5-yl)phenyl]acetamide
P616-0067 Screening compound: N-[3-(3-{[1,2,4]triazolo[4,3-a]pyridin-6-yl}-1,2,4-oxadiazol-5-yl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P616-0067
N-[3-(3-{[1,2,4]triazolo[4,3-a]pyridin-6-yl}-1,2,4-oxadiazol-5-yl)phenyl]acetamide

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

P616-0067

Molecular Formula

C16H12N6O2 (C16 H12 N6 O2)

Compound Name

N-[3-(3-{[1,2,4]triazolo[4,3-a]pyridin-6-yl}-1,2,4-oxadiazol-5-yl)phenyl]acetamide

IUPAC name

N-[3-(3-{[124]triazolo[43-a]pyridin-6-yl}-124-oxadiazol-5-yl)phenyl]acetamide

SMILES

CC(Nc1cc(-c2nc(-c(cc3)cn4c3nnc4)no2)ccc1)=O

InChI

InChI=1S/C16H12N6O2/c1-10(23)18-13-4-2-3-11(7-13)16-19-15(21-24-16)12-5-6-14-20-17-9-22(14)8-12/h2-9H,1H3,(H,18,23)

InChI Key

NOACBTYURTXJNH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27606695

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.998

Distribution Coefficient, logD

1.998

Water Solubility, LogSw

-2.57

Polar Surface Area

77.852

Acid Dissociation Constant (pKa)

13.54

Base Dissociation Constant (pKb)

3.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

P616-0067 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P616-0067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P616-0067?
Check Price and Availability of P616-0067, 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 P616-0067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P616-0067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P616-0067
  • 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 P616-0067 available by request