P890-2217 Screening compound: 3,4-dimethoxy-N-{1-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]cyclohexyl}benzamide

P890-2217 Screening compound: 3,4-dimethoxy-N-{1-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]cyclohexyl}benzamide
P890-2217 Screening compound: 3,4-dimethoxy-N-{1-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]cyclohexyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P890-2217
3,4-dimethoxy-N-{1-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]cyclohexyl}benzamide

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

P890-2217

Molecular Formula

C22H24N4O4 (C22 H24 N4 O4)

Compound Name

3,4-dimethoxy-N-{1-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]cyclohexyl}benzamide

IUPAC name

34-dimethoxy-N-{1-[3-(pyridin-4-yl)-124-oxadiazol-5-yl]cyclohexyl}benzamide

SMILES

COc(ccc(C(NC1(CCCCC1)c1nc(-c2ccncc2)no1)=O)c1)c1OC

InChI

InChI=1S/C22H24N4O4/c1-28-17-7-6-16(14-18(17)29-2)20(27)25-22(10-4-3-5-11-22)21-24-19(26-30-21)15-8-12-23-13-9-15/h6-9,12-14H,3-5,10-11H2,1-2H3,(H,25,27)

InChI Key

XSGDURSWWUSNIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29028212

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.270

Distribution Coefficient, logD

3.270

Water Solubility, LogSw

-3.40

Polar Surface Area

80.510

Acid Dissociation Constant (pKa)

12.79

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

P890-2217 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P890-2217 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P890-2217?
Check Price and Availability of P890-2217, 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 P890-2217 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P890-2217
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P890-2217
  • 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 P890-2217 available by request