F052-0061 Screening compound: 2-(azepan-1-yl)-6-(piperidine-1-sulfonyl)quinoline

F052-0061 Screening compound: 2-(azepan-1-yl)-6-(piperidine-1-sulfonyl)quinoline
F052-0061 Screening compound: 2-(azepan-1-yl)-6-(piperidine-1-sulfonyl)quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound F052-0061
2-(azepan-1-yl)-6-(piperidine-1-sulfonyl)quinoline

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

F052-0061

Molecular Formula

C20H27N3O2S (C20 H27 N3 O2 S)

Compound Name

2-(azepan-1-yl)-6-(piperidine-1-sulfonyl)quinoline

IUPAC name

2-(azepan-1-yl)-6-(piperidine-1-sulfonyl)quinoline

SMILES

O=S(c1cc2ccc(N3CCCCCC3)nc2cc1)(N1CCCCC1)=O

InChI

InChI=1S/C20H27N3O2S/c24-26(25,23-14-6-3-7-15-23)18-9-10-19-17(16-18)8-11-20(21-19)22-12-4-1-2-5-13-22/h8-11,16H,1-7,12-15H2

InChI Key

JNQNCLVGAABHCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14938231

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.544

Distribution Coefficient, logD

4.543

Water Solubility, LogSw

-4.49

Polar Surface Area

43.527

Acid Dissociation Constant (pKa)

24.60

Base Dissociation Constant (pKb)

4.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.00

F052-0061 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F052-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F052-0061?
Check Price and Availability of F052-0061, 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 F052-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F052-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F052-0061
  • 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 F052-0061 available by request