M428-0766 Screening compound: N-(2-fluoro-4-methylphenyl)-2-[(6-{3-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-2-yl}pyridazin-3-yl)sulfanyl]acetamide

M428-0766 Screening compound: N-(2-fluoro-4-methylphenyl)-2-[(6-{3-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-2-yl}pyridazin-3-yl)sulfanyl]acetamide
M428-0766 Screening compound: N-(2-fluoro-4-methylphenyl)-2-[(6-{3-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-2-yl}pyridazin-3-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M428-0766
N-(2-fluoro-4-methylphenyl)-2-[(6-{3-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-2-yl}pyridazin-3-yl)sulfanyl]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

M428-0766

Molecular Formula

C20H20FN5OS (C20 H20 FN5 OS)

Compound Name

N-(2-fluoro-4-methylphenyl)-2-[(6-{3-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-2-yl}pyridazin-3-yl)sulfanyl]acetamide

IUPAC name

N-(2-fluoro-4-methylphenyl)-2-[(6-{3-methyl-2H4H5H6H-cyclopenta[c]pyrazol-2-yl}pyridazin-3-yl)sulfanyl]acetamide

SMILES

Cc1c(CCC2)c2nn1-c(cc1)nnc1SCC(Nc(ccc(C)c1)c1F)=O

InChI

InChI=1S/C20H20FN5OS/c1-12-6-7-17(15(21)10-12)22-19(27)11-28-20-9-8-18(23-24-20)26-13(2)14-4-3-5-16(14)25-26/h6-10H,3-5,11H2,1-2H3,(H,22,27)

InChI Key

MMIZSCABCDMKTN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27541245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.428

Distribution Coefficient, logD

3.427

Water Solubility, LogSw

-3.86

Polar Surface Area

58.614

Acid Dissociation Constant (pKa)

10.71

Base Dissociation Constant (pKb)

4.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

M428-0766 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

GABA Library (7115 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Eye
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M428-0766 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M428-0766?
Check Price and Availability of M428-0766, 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 M428-0766 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M428-0766
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M428-0766
  • 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 M428-0766 available by request