L703-5641 Screening compound: 3-fluoro-4-{4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl}benzonitrile

L703-5641 Screening compound: 3-fluoro-4-{4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl}benzonitrile
L703-5641 Screening compound: 3-fluoro-4-{4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl}benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound L703-5641
3-fluoro-4-{4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl}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

L703-5641

Molecular Formula

C22H19FN4O3 (C22 H19 FN4 O3)

Compound Name

3-fluoro-4-{4-[5-(3-methoxyphenyl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl}benzonitrile

IUPAC name

3-fluoro-4-{4-[5-(3-methoxyphenyl)-124-oxadiazol-3-yl]piperidine-1-carbonyl}benzonitrile

SMILES

COc1cccc(-c2nc(C(CC3)CCN3C(c(ccc(C#N)c3)c3F)=O)no2)c1

InChI

InChI=1S/C22H19FN4O3/c1-29-17-4-2-3-16(12-17)21-25-20(26-30-21)15-7-9-27(10-8-15)22(28)18-6-5-14(13-24)11-19(18)23/h2-6,11-12,15H,7-10H2,1H3

InChI Key

YKMOLWRUVGNWQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27471426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.814

Distribution Coefficient, logD

3.814

Water Solubility, LogSw

-4.00

Polar Surface Area

72.893

Acid Dissociation Constant (pKa)

26.40

Base Dissociation Constant (pKb)

-1.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

L703-5641 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L703-5641 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L703-5641?
Check Price and Availability of L703-5641, 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 L703-5641 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L703-5641
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L703-5641
  • 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 L703-5641 available by request