F126-0094 Screening compound: 4-(piperidinomethyl)-1-{[2-(trifluoromethyl)phenyl]sulfonyl}piperidine

F126-0094 Screening compound: 4-(piperidinomethyl)-1-{[2-(trifluoromethyl)phenyl]sulfonyl}piperidine
F126-0094 Screening compound: 4-(piperidinomethyl)-1-{[2-(trifluoromethyl)phenyl]sulfonyl}piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound F126-0094
4-(piperidinomethyl)-1-{[2-(trifluoromethyl)phenyl]sulfonyl}piperidine

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

F126-0094

Molecular Formula

C18H25F3N2O2S (C18 H25 F3 N2 O2 S)

Compound Name

4-(piperidinomethyl)-1-{[2-(trifluoromethyl)phenyl]sulfonyl}piperidine

IUPAC name

4-[(piperidin-1-yl)methyl]-1-[2-(trifluoromethyl)benzenesulfonyl]piperidine

SMILES

O=S(c1c(C(F)(F)F)cccc1)(N1CCC(CN2CCCCC2)CC1)=O

InChI

InChI=1S/C18H25F3N2O2S/c19-18(20,21)16-6-2-3-7-17(16)26(24,25)23-12-8-15(9-13-23)14-22-10-4-1-5-11-22/h2-3,6-7,15H,1,4-5,8-14H2

InChI Key

KDARRGOHCCMDKC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14942479

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.881

Distribution Coefficient, logD

0.943

Water Solubility, LogSw

-4.10

Polar Surface Area

35.682

Acid Dissociation Constant (pKa)

26.35

Base Dissociation Constant (pKb)

10.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.67

F126-0094 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 F126-0094 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F126-0094?
Check Price and Availability of F126-0094, 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 F126-0094 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F126-0094
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F126-0094
  • 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 F126-0094 available by request