CM2897-5952 Screening compound: 1-[3-(3-benzyl-1,2,4-oxadiazol-5-yl)-1-azetanyl]-2-(2-chlorophenyl)-1-ethanone

CM2897-5952 Screening compound: 1-[3-(3-benzyl-1,2,4-oxadiazol-5-yl)-1-azetanyl]-2-(2-chlorophenyl)-1-ethanone
CM2897-5952 Screening compound: 1-[3-(3-benzyl-1,2,4-oxadiazol-5-yl)-1-azetanyl]-2-(2-chlorophenyl)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound CM2897-5952
1-[3-(3-benzyl-1,2,4-oxadiazol-5-yl)-1-azetanyl]-2-(2-chlorophenyl)-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

CM2897-5952

Molecular Formula

C20H18ClN3O2 (C20 H18 ClN3 O2)

Compound Name

1-[3-(3-benzyl-1,2,4-oxadiazol-5-yl)-1-azetanyl]-2-(2-chlorophenyl)-1-ethanone

IUPAC name

n/a

SMILES

O=C(Cc(cccc1)c1Cl)N(C1)CC1c1nc(Cc2ccccc2)no1

InChI

InChI=1S/C20H18ClN3O2/c21-17-9-5-4-8-15(17)11-19(25)24-12-16(13-24)20-22-18(23-26-20)10-14-6-2-1-3-7-14/h1-9,16H,10-13H2

InChI Key

JFHNSEUISFKABC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30459601

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.206

Distribution Coefficient, logD

4.206

Water Solubility, LogSw

-4.31

Polar Surface Area

48.954

Acid Dissociation Constant (pKa)

17.36

Base Dissociation Constant (pKb)

5.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

CM2897-5952 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with CM2897-5952 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM2897-5952?
Check Price and Availability of CM2897-5952, 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 CM2897-5952 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM2897-5952
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM2897-5952
  • 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 CM2897-5952 available by request