P549-0002 Screening compound: 5-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-2-(1H-pyrazol-1-yl)pyridine

P549-0002 Screening compound: 5-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-2-(1H-pyrazol-1-yl)pyridine
P549-0002 Screening compound: 5-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-2-(1H-pyrazol-1-yl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound P549-0002
5-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-2-(1H-pyrazol-1-yl)pyridine

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

P549-0002

Molecular Formula

C17H13N5O2 (C17 H13 N5 O2)

Compound Name

5-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]-2-(1H-pyrazol-1-yl)pyridine

IUPAC name

5-[5-(3-methoxyphenyl)-124-oxadiazol-3-yl]-2-(1H-pyrazol-1-yl)pyridine

SMILES

COc1cccc(-c2nc(-c(cc3)cnc3-n3nccc3)no2)c1

InChI

InChI=1S/C17H13N5O2/c1-23-14-5-2-4-12(10-14)17-20-16(21-24-17)13-6-7-15(18-11-13)22-9-3-8-19-22/h2-11H,1H3

InChI Key

XWASYXQZJPKSRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27604276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.32

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

3.455

Distribution Coefficient, logD

3.251

Water Solubility, LogSw

-3.64

Polar Surface Area

62.164

Acid Dissociation Constant (pKa)

32.86

Base Dissociation Constant (pKb)

7.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

P549-0002 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system

References: we are preparing a list of scientific research reports with P549-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P549-0002?
Check Price and Availability of P549-0002, 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 P549-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P549-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P549-0002
  • 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 P549-0002 available by request