E685-0042 Screening compound: N-[2-(4-ethylpiperazine-1-carbonyl)pyridin-4-yl]-4-fluorobenzene-1-sulfonamide

E685-0042 Screening compound: N-[2-(4-ethylpiperazine-1-carbonyl)pyridin-4-yl]-4-fluorobenzene-1-sulfonamide
E685-0042 Screening compound: N-[2-(4-ethylpiperazine-1-carbonyl)pyridin-4-yl]-4-fluorobenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E685-0042
N-[2-(4-ethylpiperazine-1-carbonyl)pyridin-4-yl]-4-fluorobenzene-1-sulfonamide

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

E685-0042

Molecular Formula

C18H21FN4O3S (C18 H21 FN4 O3 S)

Compound Name

N-[2-(4-ethylpiperazine-1-carbonyl)pyridin-4-yl]-4-fluorobenzene-1-sulfonamide

IUPAC name

N-[2-(4-ethylpiperazine-1-carbonyl)pyridin-4-yl]-4-fluorobenzene-1-sulfonamide

SMILES

CCN(CC1)CCN1C(c1nccc(NS(c(cc2)ccc2F)(=O)=O)c1)=O

InChI

InChI=1S/C18H21FN4O3S/c1-2-22-9-11-23(12-10-22)18(24)17-13-15(7-8-20-17)21-27(25,26)16-5-3-14(19)4-6-16/h3-8,13H,2,9-12H2,1H3,(H,20,21)

InChI Key

NVMITGTZGMTONG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14909952

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.752

Distribution Coefficient, logD

1.334

Water Solubility, LogSw

-2.76

Polar Surface Area

70.121

Acid Dissociation Constant (pKa)

7.19

Base Dissociation Constant (pKb)

7.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

E685-0042 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
Mechanism of action:
  • Epigenetic
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with E685-0042 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E685-0042?
Check Price and Availability of E685-0042, 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 E685-0042 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E685-0042
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E685-0042
  • 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 E685-0042 available by request