F126-0297 Screening compound: 1-{[1-(4-propylbenzenesulfonyl)piperidin-4-yl]methyl}azepane

F126-0297 Screening compound: 1-{[1-(4-propylbenzenesulfonyl)piperidin-4-yl]methyl}azepane
F126-0297 Screening compound: 1-{[1-(4-propylbenzenesulfonyl)piperidin-4-yl]methyl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound F126-0297
1-{[1-(4-propylbenzenesulfonyl)piperidin-4-yl]methyl}azepane

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

F126-0297

Molecular Formula

C21H34N2O2S (C21 H34 N2 O2 S)

Compound Name

1-{[1-(4-propylbenzenesulfonyl)piperidin-4-yl]methyl}azepane

IUPAC name

1-{[1-(4-propylbenzenesulfonyl)piperidin-4-yl]methyl}azepane

SMILES

CCCc(cc1)ccc1S(N1CCC(CN2CCCCCC2)CC1)(=O)=O

InChI

InChI=1S/C21H34N2O2S/c1-2-7-19-8-10-21(11-9-19)26(24,25)23-16-12-20(13-17-23)18-22-14-5-3-4-6-15-22/h8-11,20H,2-7,12-18H2,1H3

InChI Key

FCTUTGXDHKNNOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14942549

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.996

Distribution Coefficient, logD

2.083

Water Solubility, LogSw

-4.51

Polar Surface Area

36.013

Acid Dissociation Constant (pKa)

26.35

Base Dissociation Constant (pKb)

10.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

71.40

F126-0297 in Drug Discovery

Included in Screening Libraries

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
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with F126-0297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F126-0297?
Check Price and Availability of F126-0297, 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 F126-0297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F126-0297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F126-0297
  • 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 F126-0297 available by request