3706-1402 Screening compound: N-(2-fluorophenyl)-4-methyl-N-[2-oxo-2-(4-phenylpiperazino)ethyl]-1-benzenesulfonamide

3706-1402 Screening compound: N-(2-fluorophenyl)-4-methyl-N-[2-oxo-2-(4-phenylpiperazino)ethyl]-1-benzenesulfonamide
3706-1402 Screening compound: N-(2-fluorophenyl)-4-methyl-N-[2-oxo-2-(4-phenylpiperazino)ethyl]-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3706-1402
N-(2-fluorophenyl)-4-methyl-N-[2-oxo-2-(4-phenylpiperazino)ethyl]-1-benzenesulfonamide

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

3706-1402

Molecular Formula

C25H26FN3O3S (C25 H26 FN3 O3 S)

Compound Name

N-(2-fluorophenyl)-4-methyl-N-[2-oxo-2-(4-phenylpiperazino)ethyl]-1-benzenesulfonamide

IUPAC name

N-(2-fluorophenyl)-4-methyl-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]benzene-1-sulfonamide

SMILES

Cc(cc1)ccc1S(N(CC(N(CC1)CCN1c1ccccc1)=O)c(cccc1)c1F)(=O)=O

InChI

InChI=1S/C25H26FN3O3S/c1-20-11-13-22(14-12-20)33(31,32)29(24-10-6-5-9-23(24)26)19-25(30)28-17-15-27(16-18-28)21-7-3-2-4-8-21/h2-14H,15-19H2,1H3

InChI Key

QYDMMUKYRKPWDI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01968869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.040

Distribution Coefficient, logD

4.040

Water Solubility, LogSw

-4.03

Polar Surface Area

51.144

Acid Dissociation Constant (pKa)

20.71

Base Dissociation Constant (pKb)

3.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

3706-1402 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral HBV Library (10007 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 3706-1402 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3706-1402?
Check Price and Availability of 3706-1402, 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 3706-1402 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3706-1402
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3706-1402
  • 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 3706-1402 available by request