M034-4781 Screening compound: N-(3-chloro-4-fluorophenyl)-4-[3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridin-2-yl]piperazine-1-carboxamide

M034-4781 Screening compound: N-(3-chloro-4-fluorophenyl)-4-[3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridin-2-yl]piperazine-1-carboxamide
M034-4781 Screening compound: N-(3-chloro-4-fluorophenyl)-4-[3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridin-2-yl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M034-4781
N-(3-chloro-4-fluorophenyl)-4-[3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridin-2-yl]piperazine-1-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

M034-4781

Molecular Formula

C21H20ClFN6O2 (C21 H20 ClFN6 O2)

Compound Name

N-(3-chloro-4-fluorophenyl)-4-[3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)pyridin-2-yl]piperazine-1-carboxamide

IUPAC name

N-(3-chloro-4-fluorophenyl)-4-[3-(5-cyclopropyl-134-oxadiazol-2-yl)pyridin-2-yl]piperazine-1-carboxamide

SMILES

O=C(Nc(cc1)cc(Cl)c1F)N(CC1)CCN1c1ncccc1-c1nnc(C2CC2)o1

InChI

InChI=1S/C21H20ClFN6O2/c22-16-12-14(5-6-17(16)23)25-21(30)29-10-8-28(9-11-29)18-15(2-1-7-24-18)20-27-26-19(31-20)13-3-4-13/h1-2,5-7,12-13H,3-4,8-11H2,(H,25,30)

InChI Key

GHAXICDUYDZQOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29028655

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.88

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.856

Distribution Coefficient, logD

3.511

Water Solubility, LogSw

-4.41

Polar Surface Area

68.716

Acid Dissociation Constant (pKa)

10.35

Base Dissociation Constant (pKb)

7.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

M034-4781 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Inflammatory Library (24602 compounds)

Bcl2-PPI Inhibitors Library (12246 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Hemic and lymphatic
  • Nervous system
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with M034-4781 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M034-4781?
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What is the minimum amount of M034-4781 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M034-4781
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M034-4781
  • 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 M034-4781 available by request