SA58-0961 Screening compound: 2-(3-{2-[1-(pyridine-2-carbonyl)pyrrolidin-2-yl]ethyl}-1,2,4-oxadiazol-5-yl)pyridine

SA58-0961 Screening compound: 2-(3-{2-[1-(pyridine-2-carbonyl)pyrrolidin-2-yl]ethyl}-1,2,4-oxadiazol-5-yl)pyridine
SA58-0961 Screening compound: 2-(3-{2-[1-(pyridine-2-carbonyl)pyrrolidin-2-yl]ethyl}-1,2,4-oxadiazol-5-yl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA58-0961
2-(3-{2-[1-(pyridine-2-carbonyl)pyrrolidin-2-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

SA58-0961

Molecular Formula

C19H19N5O2 (C19 H19 N5 O2)

Compound Name

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

IUPAC name

2-(3-{2-[1-(pyridine-2-carbonyl)pyrrolidin-2-yl]ethyl}-124-oxadiazol-5-yl)pyridine

SMILES

O=C(c1ncccc1)N1C(CCc2noc(-c3ncccc3)n2)CCC1

InChI

InChI=1S/C19H19N5O2/c25-19(16-8-2-4-12-21-16)24-13-5-6-14(24)9-10-17-22-18(26-23-17)15-7-1-3-11-20-15/h1-4,7-8,11-12,14H,5-6,9-10,13H2/t14-/m1/s1

InChI Key

DFXCNPSQOKKTIH-CQSZACIVSA-N

MDL Number (MFCD)

MFCD31999247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.868

Distribution Coefficient, logD

1.868

Water Solubility, LogSw

-1.87

Polar Surface Area

67.391

Acid Dissociation Constant (pKa)

25.27

Base Dissociation Constant (pKb)

3.41

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.58

SA58-0961 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SA58-0961 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA58-0961?
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What is the minimum amount of SA58-0961 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA58-0961
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA58-0961
  • 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 SA58-0961 available by request