P642-0796 Screening compound: 3-[2-(4-methylpiperidin-1-yl)pyridin-4-yl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide

P642-0796 Screening compound: 3-[2-(4-methylpiperidin-1-yl)pyridin-4-yl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
P642-0796 Screening compound: 3-[2-(4-methylpiperidin-1-yl)pyridin-4-yl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P642-0796
3-[2-(4-methylpiperidin-1-yl)pyridin-4-yl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide

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

P642-0796

Molecular Formula

C20H28N6O3 (C20 H28 N6 O3)

Compound Name

3-[2-(4-methylpiperidin-1-yl)pyridin-4-yl]-N-[2-(morpholin-4-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide

IUPAC name

3-[2-(4-methylpiperidin-1-yl)pyridin-4-yl]-N-[2-(morpholin-4-yl)ethyl]-124-oxadiazole-5-carboxamide

SMILES

CC(CC1)CCN1c1nccc(-c2noc(C(NCCN3CCOCC3)=O)n2)c1

InChI

InChI=1S/C20H28N6O3/c1-15-3-7-26(8-4-15)17-14-16(2-5-21-17)18-23-20(29-24-18)19(27)22-6-9-25-10-12-28-13-11-25/h2,5,14-15H,3-4,6-13H2,1H3,(H,22,27)

InChI Key

KVFFBSHQWZKZDP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27608889

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.371

Distribution Coefficient, logD

2.310

Water Solubility, LogSw

-2.85

Polar Surface Area

80.025

Acid Dissociation Constant (pKa)

12.62

Base Dissociation Constant (pKb)

6.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

P642-0796 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with P642-0796 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P642-0796?
Check Price and Availability of P642-0796, 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 P642-0796 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P642-0796
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P642-0796
  • 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 P642-0796 available by request