CM3326-3861 Screening compound: 2-(1-methyl-4-piperidyl)-1-{4-[2-(3-tetrahydro-2H-pyran-4-yl-1,2,4-oxadiazol-5-yl)ethyl]piperidino}-1-ethanone

CM3326-3861 Screening compound: 2-(1-methyl-4-piperidyl)-1-{4-[2-(3-tetrahydro-2H-pyran-4-yl-1,2,4-oxadiazol-5-yl)ethyl]piperidino}-1-ethanone
CM3326-3861 Screening compound: 2-(1-methyl-4-piperidyl)-1-{4-[2-(3-tetrahydro-2H-pyran-4-yl-1,2,4-oxadiazol-5-yl)ethyl]piperidino}-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound CM3326-3861
2-(1-methyl-4-piperidyl)-1-{4-[2-(3-tetrahydro-2H-pyran-4-yl-1,2,4-oxadiazol-5-yl)ethyl]piperidino}-1-ethanone

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

CM3326-3861

Molecular Formula

C22H36N4O3 (C22 H36 N4 O3)

Compound Name

2-(1-methyl-4-piperidyl)-1-{4-[2-(3-tetrahydro-2H-pyran-4-yl-1,2,4-oxadiazol-5-yl)ethyl]piperidino}-1-ethanone

IUPAC name

2-(1-methylpiperidin-4-yl)-1-(4-{2-[3-(oxan-4-yl)-124-oxadiazol-5-yl]ethyl}piperidin-1-yl)ethan-1-one

SMILES

CN1CCC(CC(N2CCC(CCc3nc(C4CCOCC4)no3)CC2)=O)CC1

InChI

InChI=1S/C22H36N4O3/c1-25-10-4-18(5-11-25)16-21(27)26-12-6-17(7-13-26)2-3-20-23-22(24-29-20)19-8-14-28-15-9-19/h17-19H,2-16H2,1H3

InChI Key

FEIDZHINSKXRIS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30458438

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.623

Distribution Coefficient, logD

0.713

Water Solubility, LogSw

-2.39

Polar Surface Area

59.200

Acid Dissociation Constant (pKa)

24.23

Base Dissociation Constant (pKb)

9.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

86.36

CM3326-3861 in Drug Discovery

Included in Screening Libraries

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

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

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with CM3326-3861 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM3326-3861?
Check Price and Availability of CM3326-3861, 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 CM3326-3861 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM3326-3861
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM3326-3861
  • 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 CM3326-3861 available by request