P697-0724 Screening compound: 2-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-N-[(4-fluorophenyl)methyl]acetamide

P697-0724 Screening compound: 2-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-N-[(4-fluorophenyl)methyl]acetamide
P697-0724 Screening compound: 2-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-N-[(4-fluorophenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P697-0724
2-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-N-[(4-fluorophenyl)methyl]acetamide

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

P697-0724

Molecular Formula

C22H22F2N4O2 (C22 H22 F2 N4 O2)

Compound Name

2-{2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-N-[(4-fluorophenyl)methyl]acetamide

IUPAC name

2-{2-[3-(4-fluorophenyl)-124-oxadiazol-5-yl]piperidin-1-yl}-N-[(4-fluorophenyl)methyl]acetamide

SMILES

O=C(CN(CCCC1)C1c1nc(-c(cc2)ccc2F)no1)NCc(cc1)ccc1F

InChI

InChI=1S/C22H22F2N4O2/c23-17-8-4-15(5-9-17)13-25-20(29)14-28-12-2-1-3-19(28)22-26-21(27-30-22)16-6-10-18(24)11-7-16/h4-11,19H,1-3,12-14H2,(H,25,29)/t19-/m0/s1

InChI Key

SMQATQPNWJNPES-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27612243

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.201

Distribution Coefficient, logD

4.201

Water Solubility, LogSw

-4.21

Polar Surface Area

59.708

Acid Dissociation Constant (pKa)

12.65

Base Dissociation Constant (pKb)

3.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

P697-0724 in Drug Discovery

Included in Screening Libraries

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

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P697-0724 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P697-0724?
Check Price and Availability of P697-0724, 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 P697-0724 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P697-0724
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P697-0724
  • 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 P697-0724 available by request