SA67-0023 Screening compound: 8-({3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}sulfonyl)quinoline

SA67-0023 Screening compound: 8-({3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}sulfonyl)quinoline
SA67-0023 Screening compound: 8-({3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}sulfonyl)quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound SA67-0023
8-({3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}sulfonyl)quinoline

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

SA67-0023

Molecular Formula

C18H20N4O3S (C18 H20 N4 O3 S)

Compound Name

8-({3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}sulfonyl)quinoline

IUPAC name

8-({3-[2-(5-methyl-124-oxadiazol-3-yl)ethyl]pyrrolidin-1-yl}sulfonyl)quinoline

SMILES

Cc1nc(CCC(CC2)CN2S(c2cccc3cccnc23)(=O)=O)no1

InChI

InChI=1S/C18H20N4O3S/c1-13-20-17(21-25-13)8-7-14-9-11-22(12-14)26(23,24)16-6-2-4-15-5-3-10-19-18(15)16/h2-6,10,14H,7-9,11-12H2,1H3/t14-/m1/s1

InChI Key

KCBUXJLKNSPEEJ-CQSZACIVSA-N

MDL Number (MFCD)

MFCD32002125

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.261

Distribution Coefficient, logD

2.261

Water Solubility, LogSw

-2.53

Polar Surface Area

73.678

Acid Dissociation Constant (pKa)

25.15

Base Dissociation Constant (pKb)

-0.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.89

SA67-0023 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

KRAS-Targeted Library (16000 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA67-0023 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA67-0023?
Check Price and Availability of SA67-0023, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of SA67-0023 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA67-0023
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA67-0023
  • 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 SA67-0023 available by request