L828-0863 Screening compound: 4-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-sulfamoylphenyl)thiophene-2-sulfonamide

L828-0863 Screening compound: 4-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-sulfamoylphenyl)thiophene-2-sulfonamide
L828-0863 Screening compound: 4-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-sulfamoylphenyl)thiophene-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L828-0863
4-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-sulfamoylphenyl)thiophene-2-sulfonamide

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

L828-0863

Molecular Formula

C18H13FN4O5S3 (C18 H13 FN4 O5 S3)

Compound Name

4-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-(4-sulfamoylphenyl)thiophene-2-sulfonamide

IUPAC name

4-[3-(3-fluorophenyl)-124-oxadiazol-5-yl]-N-(4-sulfamoylphenyl)thiophene-2-sulfonamide

SMILES

NS(c(cc1)ccc1NS(c1cc(-c2nc(-c3cc(F)ccc3)no2)cs1)(=O)=O)(=O)=O

InChI

InChI=1S/C18H13FN4O5S3/c19-13-3-1-2-11(8-13)17-21-18(28-22-17)12-9-16(29-10-12)31(26,27)23-14-4-6-15(7-5-14)30(20,24)25/h1-10,23H,(H2,20,24,25)

InChI Key

HAHLAGKDHHLHLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27478528

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.52

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.401

Distribution Coefficient, logD

3.041

Water Solubility, LogSw

-3.94

Polar Surface Area

123.915

Acid Dissociation Constant (pKa)

7.29

Base Dissociation Constant (pKb)

-4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

L828-0863 in Drug Discovery

Included in Screening Libraries

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

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Proteases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L828-0863 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L828-0863?
Check Price and Availability of L828-0863, 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 L828-0863 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L828-0863
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L828-0863
  • 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 L828-0863 available by request