M321-0598 Screening compound: 3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-5-(1-phenylcyclopropyl)-1,2,4-oxadiazole

M321-0598 Screening compound: 3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-5-(1-phenylcyclopropyl)-1,2,4-oxadiazole
M321-0598 Screening compound: 3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-5-(1-phenylcyclopropyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound M321-0598
3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-5-(1-phenylcyclopropyl)-1,2,4-oxadiazole

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

M321-0598

Molecular Formula

C22H20N4O (C22 H20 N4 O)

Compound Name

3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-5-(1-phenylcyclopropyl)-1,2,4-oxadiazole

IUPAC name

3-[3-(1-ethyl-1H-pyrazol-5-yl)phenyl]-5-(1-phenylcyclopropyl)-124-oxadiazole

SMILES

CCn1nccc1-c1cccc(-c2noc(C3(CC3)c3ccccc3)n2)c1

InChI

InChI=1S/C22H20N4O/c1-2-26-19(11-14-23-26)16-7-6-8-17(15-16)20-24-21(27-25-20)22(12-13-22)18-9-4-3-5-10-18/h3-11,14-15H,2,12-13H2,1H3

InChI Key

ILSDBBAYRBGUFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27536114

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.602

Distribution Coefficient, logD

4.602

Water Solubility, LogSw

-4.46

Polar Surface Area

44.713

Acid Dissociation Constant (pKa)

22.14

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

M321-0598 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

SmartTM Library (51161 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with M321-0598 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M321-0598?
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What is the minimum amount of M321-0598 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M321-0598
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M321-0598
  • 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 M321-0598 available by request