C095-0067 Screening compound: 3-fluoro-N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]benzamide

C095-0067 Screening compound: 3-fluoro-N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]benzamide
C095-0067 Screening compound: 3-fluoro-N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C095-0067
3-fluoro-N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]benzamide

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

C095-0067

Molecular Formula

C22H22FN3O (C22 H22 FN3 O)

Compound Name

3-fluoro-N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]benzamide

IUPAC name

3-fluoro-N-[4-methyl-2-(piperidin-1-yl)quinolin-6-yl]benzamide

SMILES

Cc1c(cc(cc2)NC(c3cccc(F)c3)=O)c2nc(N2CCCCC2)c1

InChI

InChI=1S/C22H22FN3O/c1-15-12-21(26-10-3-2-4-11-26)25-20-9-8-18(14-19(15)20)24-22(27)16-6-5-7-17(23)13-16/h5-9,12-14H,2-4,10-11H2,1H3,(H,24,27)

InChI Key

JEGNUAPSMAQUAV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14719029

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.612

Distribution Coefficient, logD

5.600

Water Solubility, LogSw

-5.50

Polar Surface Area

34.576

Acid Dissociation Constant (pKa)

8.96

Base Dissociation Constant (pKb)

4.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

C095-0067 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Lipid Metabolism Library (9174 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with C095-0067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C095-0067?
Check Price and Availability of C095-0067, 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 C095-0067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C095-0067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C095-0067
  • 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 C095-0067 available by request