SA72-0958 Screening compound: 2-[4-(2-methoxyethyl)-4-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl]-5-methylpyrazine

SA72-0958 Screening compound: 2-[4-(2-methoxyethyl)-4-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl]-5-methylpyrazine
SA72-0958 Screening compound: 2-[4-(2-methoxyethyl)-4-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl]-5-methylpyrazine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA72-0958
2-[4-(2-methoxyethyl)-4-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl]-5-methylpyrazine

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

SA72-0958

Molecular Formula

C21H24N6O3 (C21 H24 N6 O3)

Compound Name

2-[4-(2-methoxyethyl)-4-[5-(pyridin-4-yl)-1,2,4-oxadiazol-3-yl]piperidine-1-carbonyl]-5-methylpyrazine

IUPAC name

2-[4-(2-methoxyethyl)-4-[5-(pyridin-4-yl)-124-oxadiazol-3-yl]piperidine-1-carbonyl]-5-methylpyrazine

SMILES

Cc(nc1)cnc1C(N(CC1)CCC1(CCOC)c1noc(-c2ccncc2)n1)=O

InChI

InChI=1S/C21H24N6O3/c1-15-13-24-17(14-23-15)19(28)27-10-5-21(6-11-27,7-12-29-2)20-25-18(30-26-20)16-3-8-22-9-4-16/h3-4,8-9,13-14H,5-7,10-12H2,1-2H3

InChI Key

PDJLUEBVGMLFBC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32240675

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.46

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.342

Distribution Coefficient, logD

1.342

Water Solubility, LogSw

-1.11

Polar Surface Area

84.145

Acid Dissociation Constant (pKa)

27.19

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.86

SA72-0958 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA72-0958 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA72-0958?
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What is the minimum amount of SA72-0958 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA72-0958
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA72-0958
  • 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 SA72-0958 available by request