SA67-1073 Screening compound: 3-{3-[2-(pyrrolidin-3-yl)ethyl]-1,2,4-oxadiazol-5-yl}pyridine

SA67-1073 Screening compound: 3-{3-[2-(pyrrolidin-3-yl)ethyl]-1,2,4-oxadiazol-5-yl}pyridine
SA67-1073 Screening compound: 3-{3-[2-(pyrrolidin-3-yl)ethyl]-1,2,4-oxadiazol-5-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA67-1073
3-{3-[2-(pyrrolidin-3-yl)ethyl]-1,2,4-oxadiazol-5-yl}pyridine

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

SA67-1073

Molecular Formula

C13H16N4O (C13 H16 N4 O)

Compound Name

3-{3-[2-(pyrrolidin-3-yl)ethyl]-1,2,4-oxadiazol-5-yl}pyridine

IUPAC name

3-{3-[2-(pyrrolidin-3-yl)ethyl]-124-oxadiazol-5-yl}pyridine

SMILES

C(Cc1noc(-c2cnccc2)n1)C1CNCC1

InChI

InChI=1S/C13H16N4O/c1-2-11(9-14-6-1)13-16-12(17-18-13)4-3-10-5-7-15-8-10/h1-2,6,9-10,15H,3-5,7-8H2/t10-/m0/s1

InChI Key

BKSBLGIZZPKEAM-JTQLQIEISA-N

MDL Number (MFCD)

MFCD32200559

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

244.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.183

Distribution Coefficient, logD

-2.694

Water Solubility, LogSw

-1.00

Polar Surface Area

54.602

Acid Dissociation Constant (pKa)

25.15

Base Dissociation Constant (pKb)

11.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.15

SA67-1073 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

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

CNS MPO Library (28609 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with SA67-1073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA67-1073?
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What is the minimum amount of SA67-1073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA67-1073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA67-1073
  • 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 SA67-1073 available by request