F447-0440 Screening compound: 6-(4-ethylbenzenesulfonamido)-2-(4-methylpiperazin-1-yl)quinoline-4-carboxylic acid

F447-0440 Screening compound: 6-(4-ethylbenzenesulfonamido)-2-(4-methylpiperazin-1-yl)quinoline-4-carboxylic acid
F447-0440 Screening compound: 6-(4-ethylbenzenesulfonamido)-2-(4-methylpiperazin-1-yl)quinoline-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound F447-0440
6-(4-ethylbenzenesulfonamido)-2-(4-methylpiperazin-1-yl)quinoline-4-carboxylic acid

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

F447-0440

Molecular Formula

C23H26N4O4S (C23 H26 N4 O4 S)

Compound Name

6-(4-ethylbenzenesulfonamido)-2-(4-methylpiperazin-1-yl)quinoline-4-carboxylic acid

IUPAC name

6-(4-ethylbenzenesulfonamido)-2-(4-methylpiperazin-1-yl)quinoline-4-carboxylic acid

SMILES

CCc(cc1)ccc1S(Nc(ccc1nc(N2CCN(C)CC2)c2)cc1c2C(O)=O)(=O)=O

InChI

InChI=1S/C23H26N4O4S/c1-3-16-4-7-18(8-5-16)32(30,31)25-17-6-9-21-19(14-17)20(23(28)29)15-22(24-21)27-12-10-26(2)11-13-27/h4-9,14-15,25H,3,10-13H2,1-2H3,(H,28,29)

InChI Key

GYJGHMDZWGOMAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14954621

Chemical and Physical Properties

Saltdata

3HCl

Molecular Weight

454.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.610

Distribution Coefficient, logD

4.610

Water Solubility, LogSw

-4.14

Polar Surface Area

84.019

Acid Dissociation Constant (pKa)

5.05

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

F447-0440 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

CORONAVIRUS Library (20774 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

SH2 Library (10483 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with F447-0440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F447-0440?
Check Price and Availability of F447-0440, 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 F447-0440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F447-0440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F447-0440
  • 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 F447-0440 available by request