SA92-0366 Screening compound: 6-{[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl}-1H-indole

SA92-0366 Screening compound: 6-{[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl}-1H-indole
SA92-0366 Screening compound: 6-{[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl}-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound SA92-0366
6-{[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl}-1H-indole

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

SA92-0366

Molecular Formula

C17H19FN4O (C17 H19 FN4 O)

Compound Name

6-{[3-fluoro-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methyl}-1H-indole

IUPAC name

6-{[3-fluoro-3-(3-methyl-124-oxadiazol-5-yl)piperidin-1-yl]methyl}-1H-indole

SMILES

Cc1noc(C2(CN(Cc3cc([nH]cc4)c4cc3)CCC2)F)n1

InChI

InChI=1S/C17H19FN4O/c1-12-20-16(23-21-12)17(18)6-2-8-22(11-17)10-13-3-4-14-5-7-19-15(14)9-13/h3-5,7,9,19H,2,6,8,10-11H2,1H3/t17-/m0/s1

InChI Key

OLOVKEUOKGNENF-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD32243203

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.476

Distribution Coefficient, logD

2.313

Water Solubility, LogSw

-2.91

Polar Surface Area

44.976

Acid Dissociation Constant (pKa)

17.95

Base Dissociation Constant (pKb)

7.06

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.18

SA92-0366 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with SA92-0366 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA92-0366?
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What is the minimum amount of SA92-0366 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA92-0366
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA92-0366
  • 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 SA92-0366 available by request