P181-0648 Screening compound: N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-[(furan-2-yl)formamido]propanamide

P181-0648 Screening compound: N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-[(furan-2-yl)formamido]propanamide
P181-0648 Screening compound: N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-[(furan-2-yl)formamido]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P181-0648
N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-[(furan-2-yl)formamido]propanamide

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

P181-0648

Molecular Formula

C20H15FN4O4S (C20 H15 FN4 O4 S)

Compound Name

N-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-[(furan-2-yl)formamido]propanamide

IUPAC name

N-{2-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]thiophen-3-yl}-2-[(furan-2-yl)formamido]propanamide

SMILES

CC(C(Nc1c(-c2nc(-c(cc3)ccc3F)no2)scc1)=O)NC(c1ccco1)=O

InChI

InChI=1S/C20H15FN4O4S/c1-11(22-19(27)15-3-2-9-28-15)18(26)23-14-8-10-30-16(14)20-24-17(25-29-20)12-4-6-13(21)7-5-12/h2-11H,1H3,(H,22,27)(H,23,26)/t11-/m0/s1

InChI Key

CBKJCWRQXGYDTB-NSHDSACASA-N

MDL Number (MFCD)

MFCD27568303

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.708

Distribution Coefficient, logD

3.708

Water Solubility, LogSw

-4.06

Polar Surface Area

87.482

Acid Dissociation Constant (pKa)

12.62

Base Dissociation Constant (pKb)

-2.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.00

P181-0648 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with P181-0648 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P181-0648?
Check Price and Availability of P181-0648, 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 P181-0648 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P181-0648
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P181-0648
  • 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 P181-0648 available by request