SA43-0747 Screening compound: 2-(2-fluorophenyl)-1-[6-methyl-7-(3-phenyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one

SA43-0747 Screening compound: 2-(2-fluorophenyl)-1-[6-methyl-7-(3-phenyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one
SA43-0747 Screening compound: 2-(2-fluorophenyl)-1-[6-methyl-7-(3-phenyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA43-0747
2-(2-fluorophenyl)-1-[6-methyl-7-(3-phenyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]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

SA43-0747

Molecular Formula

C23H23FN4O2 (C23 H23 FN4 O2)

Compound Name

2-(2-fluorophenyl)-1-[6-methyl-7-(3-phenyl-1,2,4-oxadiazol-5-yl)-2,6-diazaspiro[3.4]octan-2-yl]ethan-1-one

IUPAC name

2-(2-fluorophenyl)-1-[6-methyl-7-(3-phenyl-124-oxadiazol-5-yl)-26-diazaspiro[3.4]octan-2-yl]ethan-1-one

SMILES

CN(CC(C1)(CN1C(Cc(cccc1)c1F)=O)C1)C1c1nc(-c2ccccc2)no1

InChI

InChI=1S/C23H23FN4O2/c1-27-13-23(14-28(15-23)20(29)11-17-9-5-6-10-18(17)24)12-19(27)22-25-21(26-30-22)16-7-3-2-4-8-16/h2-10,19H,11-15H2,1H3/t19-/m1/s1

InChI Key

LUOSFVSGLHRGTC-LJQANCHMSA-N

MDL Number (MFCD)

MFCD32237409

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.912

Distribution Coefficient, logD

3.159

Water Solubility, LogSw

-3.99

Polar Surface Area

51.570

Acid Dissociation Constant (pKa)

17.63

Base Dissociation Constant (pKb)

8.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.78

SA43-0747 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with SA43-0747 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA43-0747?
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What is the minimum amount of SA43-0747 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA43-0747
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA43-0747
  • 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 SA43-0747 available by request