G886-0115 Screening compound: 4-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}pyridine

G886-0115 Screening compound: 4-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}pyridine
G886-0115 Screening compound: 4-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound G886-0115
4-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}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

G886-0115

Molecular Formula

C18H17F3N2O (C18 H17 F3 N2 O)

Compound Name

4-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}pyridine

IUPAC name

4-{1-[2-(trifluoromethyl)benzoyl]piperidin-4-yl}pyridine

SMILES

O=C(c1c(C(F)(F)F)cccc1)N(CC1)CCC1c1ccncc1

InChI

InChI=1S/C18H17F3N2O/c19-18(20,21)16-4-2-1-3-15(16)17(24)23-11-7-14(8-12-23)13-5-9-22-10-6-13/h1-6,9-10,14H,7-8,11-12H2

InChI Key

CJXUACNKSKAEJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15072747

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.274

Distribution Coefficient, logD

3.227

Water Solubility, LogSw

-3.30

Polar Surface Area

26.043

Acid Dissociation Constant (pKa)

25.61

Base Dissociation Constant (pKb)

6.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G886-0115 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • PPI modulators
Targets:
  • Proteases
  • Ion Channels
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G886-0115 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G886-0115?
Check Price and Availability of G886-0115, 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 G886-0115 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G886-0115
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G886-0115
  • 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 G886-0115 available by request