P181-1610 Screening compound: N-{2-[3-(3,4-difluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-(2-methoxyphenoxy)acetamide

P181-1610 Screening compound: N-{2-[3-(3,4-difluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-(2-methoxyphenoxy)acetamide
P181-1610 Screening compound: N-{2-[3-(3,4-difluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-(2-methoxyphenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P181-1610
N-{2-[3-(3,4-difluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-(2-methoxyphenoxy)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

P181-1610

Molecular Formula

C21H15F2N3O4S (C21 H15 F2 N3 O4 S)

Compound Name

N-{2-[3-(3,4-difluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}-2-(2-methoxyphenoxy)acetamide

IUPAC name

N-{2-[3-(34-difluorophenyl)-124-oxadiazol-5-yl]thiophen-3-yl}-2-(2-methoxyphenoxy)acetamide

SMILES

COc(cccc1)c1OCC(Nc1c(-c2nc(-c(cc3)cc(F)c3F)no2)scc1)=O

InChI

InChI=1S/C21H15F2N3O4S/c1-28-16-4-2-3-5-17(16)29-11-18(27)24-15-8-9-31-19(15)21-25-20(26-30-21)12-6-7-13(22)14(23)10-12/h2-10H,11H2,1H3,(H,24,27)

InChI Key

UBEYFDMRNVBJOE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27568466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.776

Distribution Coefficient, logD

4.776

Water Solubility, LogSw

-4.60

Polar Surface Area

70.059

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

-3.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

P181-1610 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with P181-1610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P181-1610?
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What is the minimum amount of P181-1610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P181-1610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P181-1610
  • 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 P181-1610 available by request