P181-1026 Screening compound: 2,5-difluoro-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide

P181-1026 Screening compound: 2,5-difluoro-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide
P181-1026 Screening compound: 2,5-difluoro-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P181-1026
2,5-difluoro-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide

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

P181-1026

Molecular Formula

C20H13F2N3O2S (C20 H13 F2 N3 O2 S)

Compound Name

2,5-difluoro-N-{2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]thiophen-3-yl}benzamide

IUPAC name

25-difluoro-N-{2-[3-(3-methylphenyl)-124-oxadiazol-5-yl]thiophen-3-yl}benzamide

SMILES

Cc1cccc(-c2noc(-c(scc3)c3NC(c(cc(cc3)F)c3F)=O)n2)c1

InChI

InChI=1S/C20H13F2N3O2S/c1-11-3-2-4-12(9-11)18-24-20(27-25-18)17-16(7-8-28-17)23-19(26)14-10-13(21)5-6-15(14)22/h2-10H,1H3,(H,23,26)

InChI Key

GTXMHJGSOBDPRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27568404

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.521

Distribution Coefficient, logD

5.520

Water Solubility, LogSw

-5.48

Polar Surface Area

55.056

Acid Dissociation Constant (pKa)

9.85

Base Dissociation Constant (pKb)

-5.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

P181-1026 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with P181-1026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P181-1026?
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What is the minimum amount of P181-1026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P181-1026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P181-1026
  • 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 P181-1026 available by request