S260-0768 Screening compound: 5-{1-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3-methyl-3-piperidyl}-3-cyclopropyl-1,2,4-oxadiazole

S260-0768 Screening compound: 5-{1-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3-methyl-3-piperidyl}-3-cyclopropyl-1,2,4-oxadiazole
S260-0768 Screening compound: 5-{1-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3-methyl-3-piperidyl}-3-cyclopropyl-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound S260-0768
5-{1-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3-methyl-3-piperidyl}-3-cyclopropyl-1,2,4-oxadiazole

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

S260-0768

Molecular Formula

C19H27N5O2 (C19 H27 N5 O2)

Compound Name

5-{1-[(5-cyclopentyl-1,2,4-oxadiazol-3-yl)methyl]-3-methyl-3-piperidyl}-3-cyclopropyl-1,2,4-oxadiazole

IUPAC name

1-[(5-cyclopentyl-124-oxadiazol-3-yl)methyl]-3-(3-cyclopropyl-124-oxadiazol-5-yl)-3-methylpiperidine

SMILES

CC1(CN(Cc2noc(C3CCCC3)n2)CCC1)c1nc(C2CC2)no1

InChI

InChI=1S/C19H27N5O2/c1-19(18-21-16(23-26-18)13-7-8-13)9-4-10-24(12-19)11-15-20-17(25-22-15)14-5-2-3-6-14/h13-14H,2-12H2,1H3/t19-/m0/s1

InChI Key

QQPJORCNXKEKHS-IBGZPJMESA-N

MDL Number (MFCD)

MFCD28993788

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.807

Distribution Coefficient, logD

3.185

Water Solubility, LogSw

-3.77

Polar Surface Area

69.059

Acid Dissociation Constant (pKa)

24.36

Base Dissociation Constant (pKb)

7.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

78.95

S260-0768 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with S260-0768 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S260-0768?
Check Price and Availability of S260-0768, 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 S260-0768 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S260-0768
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S260-0768
  • 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 S260-0768 available by request