F070-0070 Screening compound: 2-(4-methylpiperidin-1-yl)-3-(trifluoromethyl)quinoxaline

F070-0070 Screening compound: 2-(4-methylpiperidin-1-yl)-3-(trifluoromethyl)quinoxaline
F070-0070 Screening compound: 2-(4-methylpiperidin-1-yl)-3-(trifluoromethyl)quinoxaline alternative view

Chemical Structure Depiction of ChemDiv screening compound F070-0070
2-(4-methylpiperidin-1-yl)-3-(trifluoromethyl)quinoxaline

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

F070-0070

Molecular Formula

C15H16F3N3 (C15 H16 F3 N3)

Compound Name

2-(4-methylpiperidin-1-yl)-3-(trifluoromethyl)quinoxaline

IUPAC name

2-(4-methylpiperidin-1-yl)-3-(trifluoromethyl)quinoxaline

SMILES

CC(CC1)CCN1c1nc2ccccc2nc1C(F)(F)F

InChI

InChI=1S/C15H16F3N3/c1-10-6-8-21(9-7-10)14-13(15(16,17)18)19-11-4-2-3-5-12(11)20-14/h2-5,10H,6-9H2,1H3

InChI Key

OPNQCIZRXXBQGU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27098518

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

295.31

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.392

Distribution Coefficient, logD

4.392

Water Solubility, LogSw

-4.28

Polar Surface Area

21.327

Acid Dissociation Constant (pKa)

23.93

Base Dissociation Constant (pKb)

4.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

F070-0070 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F070-0070 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F070-0070?
Check Price and Availability of F070-0070, 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 F070-0070 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F070-0070
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F070-0070
  • 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 F070-0070 available by request