S723-2298 Screening compound: 4-{[(4-{[1-(cyclopent-3-ene-1-carbonyl)piperidin-4-yl]methyl}phenyl)methoxy]methyl}pyridine

S723-2298 Screening compound: 4-{[(4-{[1-(cyclopent-3-ene-1-carbonyl)piperidin-4-yl]methyl}phenyl)methoxy]methyl}pyridine
S723-2298 Screening compound: 4-{[(4-{[1-(cyclopent-3-ene-1-carbonyl)piperidin-4-yl]methyl}phenyl)methoxy]methyl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound S723-2298
4-{[(4-{[1-(cyclopent-3-ene-1-carbonyl)piperidin-4-yl]methyl}phenyl)methoxy]methyl}pyridine

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

S723-2298

Molecular Formula

C25H30N2O2 (C25 H30 N2 O2)

Compound Name

4-{[(4-{[1-(cyclopent-3-ene-1-carbonyl)piperidin-4-yl]methyl}phenyl)methoxy]methyl}pyridine

IUPAC name

4-{[(4-{[1-(cyclopent-3-ene-1-carbonyl)piperidin-4-yl]methyl}phenyl)methoxy]methyl}pyridine

SMILES

O=C(C1CC=CC1)N1CCC(Cc2ccc(COCc3ccncc3)cc2)CC1

InChI

InChI=1S/C25H30N2O2/c28-25(24-3-1-2-4-24)27-15-11-21(12-16-27)17-20-5-7-22(8-6-20)18-29-19-23-9-13-26-14-10-23/h1-2,5-10,13-14,21,24H,3-4,11-12,15-19H2

InChI Key

JFBHDINEURDGRR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31968425

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.958

Distribution Coefficient, logD

3.956

Water Solubility, LogSw

-3.98

Polar Surface Area

34.764

Acid Dissociation Constant (pKa)

22.76

Base Dissociation Constant (pKb)

5.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

S723-2298 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)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S723-2298 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S723-2298?
Check Price and Availability of S723-2298, 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 S723-2298 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S723-2298
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S723-2298
  • 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 S723-2298 available by request