M027-1131 Screening compound: 3-[2-(4-fluorobenzenesulfonyl)ethyl]-N-[2-(4-sulfamoylphenyl)ethyl]-1,2,4-oxadiazole-5-carboxamide

M027-1131 Screening compound: 3-[2-(4-fluorobenzenesulfonyl)ethyl]-N-[2-(4-sulfamoylphenyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
M027-1131 Screening compound: 3-[2-(4-fluorobenzenesulfonyl)ethyl]-N-[2-(4-sulfamoylphenyl)ethyl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M027-1131
3-[2-(4-fluorobenzenesulfonyl)ethyl]-N-[2-(4-sulfamoylphenyl)ethyl]-1,2,4-oxadiazole-5-carboxamide

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

M027-1131

Molecular Formula

C19H19FN4O6S2 (C19 H19 FN4 O6 S2)

Compound Name

3-[2-(4-fluorobenzenesulfonyl)ethyl]-N-[2-(4-sulfamoylphenyl)ethyl]-1,2,4-oxadiazole-5-carboxamide

IUPAC name

3-[2-(4-fluorobenzenesulfonyl)ethyl]-N-[2-(4-sulfamoylphenyl)ethyl]-124-oxadiazole-5-carboxamide

SMILES

NS(c1ccc(CCNC(c2nc(CCS(c(cc3)ccc3F)(=O)=O)no2)=O)cc1)(=O)=O

InChI

InChI=1S/C19H19FN4O6S2/c20-14-3-7-15(8-4-14)31(26,27)12-10-17-23-19(30-24-17)18(25)22-11-9-13-1-5-16(6-2-13)32(21,28)29/h1-8H,9-12H2,(H,22,25)(H2,21,28,29)

InChI Key

URFIFTOBXOVFDB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27493661

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.51

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.420

Distribution Coefficient, logD

0.419

Water Solubility, LogSw

-2.14

Polar Surface Area

136.801

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

M027-1131 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with M027-1131 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M027-1131?
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What is the minimum amount of M027-1131 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M027-1131
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M027-1131
  • 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 M027-1131 available by request