S260-0518 Screening compound: 1-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-2-(thiophen-3-yl)ethan-1-one

S260-0518 Screening compound: 1-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-2-(thiophen-3-yl)ethan-1-one
S260-0518 Screening compound: 1-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-2-(thiophen-3-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S260-0518
1-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-2-(thiophen-3-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

S260-0518

Molecular Formula

C17H21N3O2S (C17 H21 N3 O2 S)

Compound Name

1-[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-2-(thiophen-3-yl)ethan-1-one

IUPAC name

1-[3-(3-cyclopropyl-124-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-2-(thiophen-3-yl)ethan-1-one

SMILES

CC(CCC1)(CN1C(Cc1cscc1)=O)c1nc(C2CC2)no1

InChI

InChI=1S/C17H21N3O2S/c1-17(16-18-15(19-22-16)13-3-4-13)6-2-7-20(11-17)14(21)9-12-5-8-23-10-12/h5,8,10,13H,2-4,6-7,9,11H2,1H3/t17-/m0/s1

InChI Key

PFOUCJFIDNNQCT-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD28993790

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.189

Distribution Coefficient, logD

3.189

Water Solubility, LogSw

-3.15

Polar Surface Area

49.240

Acid Dissociation Constant (pKa)

18.80

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.80

S260-0518 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

KRAS-Targeted Library (16000 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 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 S260-0518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S260-0518?
Check Price and Availability of S260-0518, 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 S260-0518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S260-0518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S260-0518
  • 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 S260-0518 available by request