F545-2169 Screening compound: 4-{3-[3-(pyrrolidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridine

F545-2169 Screening compound: 4-{3-[3-(pyrrolidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridine
F545-2169 Screening compound: 4-{3-[3-(pyrrolidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound F545-2169
4-{3-[3-(pyrrolidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-5-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

F545-2169

Molecular Formula

C18H16N4O2 (C18 H16 N4 O2)

Compound Name

4-{3-[3-(pyrrolidine-1-carbonyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridine

IUPAC name

4-{3-[3-(pyrrolidine-1-carbonyl)phenyl]-124-oxadiazol-5-yl}pyridine

SMILES

O=C(c1cc(-c2noc(-c3ccncc3)n2)ccc1)N1CCCC1

InChI

InChI=1S/C18H16N4O2/c23-18(22-10-1-2-11-22)15-5-3-4-14(12-15)16-20-17(24-21-16)13-6-8-19-9-7-13/h3-9,12H,1-2,10-11H2

InChI Key

BENHGEVUTBGOJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27175553

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.563

Distribution Coefficient, logD

2.562

Water Solubility, LogSw

-2.47

Polar Surface Area

58.087

Acid Dissociation Constant (pKa)

27.66

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

F545-2169 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with F545-2169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F545-2169?
Check Price and Availability of F545-2169, 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 F545-2169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F545-2169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F545-2169
  • 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 F545-2169 available by request