SA92-0345 Screening compound: 1-[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-(4-methylphenyl)ethan-1-one

SA92-0345 Screening compound: 1-[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-(4-methylphenyl)ethan-1-one
SA92-0345 Screening compound: 1-[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-(4-methylphenyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA92-0345
1-[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-(4-methylphenyl)ethan-1-one

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

SA92-0345

Molecular Formula

C17H20FN3O2 (C17 H20 FN3 O2)

Compound Name

1-[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-2-(4-methylphenyl)ethan-1-one

IUPAC name

1-[3-fluoro-3-(3-methyl-124-oxadiazol-5-yl)piperidin-1-yl]-2-(4-methylphenyl)ethan-1-one

SMILES

Cc1noc(C(CCC2)(CN2C(Cc2ccc(C)cc2)=O)F)n1

InChI

InChI=1S/C17H20FN3O2/c1-12-4-6-14(7-5-12)10-15(22)21-9-3-8-17(18,11-21)16-19-13(2)20-23-16/h4-7H,3,8-11H2,1-2H3/t17-/m0/s1

InChI Key

HYGNBDFRUDOENX-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD32243078

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.551

Distribution Coefficient, logD

2.551

Water Solubility, LogSw

-2.55

Polar Surface Area

47.583

Acid Dissociation Constant (pKa)

17.94

Base Dissociation Constant (pKb)

-1.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.06

SA92-0345 in Drug Discovery

Included in Screening Libraries

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA92-0345 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA92-0345?
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What is the minimum amount of SA92-0345 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA92-0345
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA92-0345
  • 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 SA92-0345 available by request