G546-0734 Screening compound: N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(pyridin-2-yl)quinoline-4-carboxamide

G546-0734 Screening compound: N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(pyridin-2-yl)quinoline-4-carboxamide
G546-0734 Screening compound: N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(pyridin-2-yl)quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G546-0734
N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(pyridin-2-yl)quinoline-4-carboxamide

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

G546-0734

Molecular Formula

C28H29N5O (C28 H29 N5 O)

Compound Name

N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(pyridin-2-yl)quinoline-4-carboxamide

IUPAC name

N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(pyridin-2-yl)quinoline-4-carboxamide

SMILES

O=C(c1cc(-c2ncccc2)nc2ccccc12)NCCN1CCN(Cc2ccccc2)CC1

InChI

InChI=1S/C28H29N5O/c34-28(30-14-15-32-16-18-33(19-17-32)21-22-8-2-1-3-9-22)24-20-27(26-12-6-7-13-29-26)31-25-11-5-4-10-23(24)25/h1-13,20H,14-19,21H2,(H,30,34)

InChI Key

BXZKEDQNKSYCFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27143844

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.744

Distribution Coefficient, logD

3.605

Water Solubility, LogSw

-4.07

Polar Surface Area

49.123

Acid Dissociation Constant (pKa)

14.10

Base Dissociation Constant (pKb)

6.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G546-0734 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G546-0734 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G546-0734?
Check Price and Availability of G546-0734, 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 G546-0734 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G546-0734
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G546-0734
  • 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 G546-0734 available by request