SA92-0136 Screening compound: N-(3-chloro-2-fluorophenyl)-3-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide

SA92-0136 Screening compound: N-(3-chloro-2-fluorophenyl)-3-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
SA92-0136 Screening compound: N-(3-chloro-2-fluorophenyl)-3-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA92-0136
N-(3-chloro-2-fluorophenyl)-3-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-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

SA92-0136

Molecular Formula

C20H17ClF2N4O2 (C20 H17 ClF2 N4 O2)

Compound Name

N-(3-chloro-2-fluorophenyl)-3-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide

IUPAC name

N-(3-chloro-2-fluorophenyl)-3-fluoro-3-(3-phenyl-124-oxadiazol-5-yl)piperidine-1-carboxamide

SMILES

O=C(Nc1cccc(Cl)c1F)N(CCC1)CC1(c1nc(-c2ccccc2)no1)F

InChI

InChI=1S/C20H17ClF2N4O2/c21-14-8-4-9-15(16(14)22)24-19(28)27-11-5-10-20(23,12-27)18-25-17(26-29-18)13-6-2-1-3-7-13/h1-4,6-9H,5,10-12H2,(H,24,28)/t20-/m0/s1

InChI Key

MTAZTKJGXWBYAN-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD32242837

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.097

Distribution Coefficient, logD

5.097

Water Solubility, LogSw

-5.52

Polar Surface Area

56.349

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

SA92-0136 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with SA92-0136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA92-0136?
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What is the minimum amount of SA92-0136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA92-0136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA92-0136
  • 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 SA92-0136 available by request