M026-0166 Screening compound: N-{3-methyl-5-[(1Z)-2-(4-{[4-(pyrimidin-2-yl)piperazin-1-yl]sulfonyl}phenyl)ethenyl]-1,2-oxazol-4-yl}acetamide

M026-0166 Screening compound: N-{3-methyl-5-[(1Z)-2-(4-{[4-(pyrimidin-2-yl)piperazin-1-yl]sulfonyl}phenyl)ethenyl]-1,2-oxazol-4-yl}acetamide
M026-0166 Screening compound: N-{3-methyl-5-[(1Z)-2-(4-{[4-(pyrimidin-2-yl)piperazin-1-yl]sulfonyl}phenyl)ethenyl]-1,2-oxazol-4-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M026-0166
N-{3-methyl-5-[(1Z)-2-(4-{[4-(pyrimidin-2-yl)piperazin-1-yl]sulfonyl}phenyl)ethenyl]-1,2-oxazol-4-yl}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

M026-0166

Molecular Formula

C22H24N6O4S (C22 H24 N6 O4 S)

Compound Name

N-{3-methyl-5-[(1Z)-2-(4-{[4-(pyrimidin-2-yl)piperazin-1-yl]sulfonyl}phenyl)ethenyl]-1,2-oxazol-4-yl}acetamide

IUPAC name

N-{3-methyl-5-[(1Z)-2-(4-{[4-(pyrimidin-2-yl)piperazin-1-yl]sulfonyl}phenyl)ethenyl]-12-oxazol-4-yl}acetamide

SMILES

CC(Nc1c(/C=C\c(cc2)ccc2S(N(CC2)CCN2c2ncccn2)(=O)=O)onc1C)=O

InChI

InChI=1S/C22H24N6O4S/c1-16-21(25-17(2)29)20(32-26-16)9-6-18-4-7-19(8-5-18)33(30,31)28-14-12-27(13-15-28)22-23-10-3-11-24-22/h3-11H,12-15H2,1-2H3,(H,25,29)

InChI Key

NAKHMPBACHPIMP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15138878

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.563

Distribution Coefficient, logD

1.562

Water Solubility, LogSw

-2.54

Polar Surface Area

96.954

Acid Dissociation Constant (pKa)

10.91

Base Dissociation Constant (pKb)

3.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

M026-0166 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M026-0166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M026-0166?
Check Price and Availability of M026-0166, 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 M026-0166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M026-0166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M026-0166
  • 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 M026-0166 available by request