K940-0478 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]acetamide

K940-0478 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]acetamide
K940-0478 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K940-0478
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]acetamide

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

K940-0478

Molecular Formula

C19H18ClF4N3O3S (C19 H18 ClF4 N3 O3 S)

Compound Name

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]acetamide

IUPAC name

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]acetamide

SMILES

O=C(CN(CC1)CCN1S(c(cc1)ccc1F)(=O)=O)Nc(cc(C(F)(F)F)cc1)c1Cl

InChI

InChI=1S/C19H18ClF4N3O3S/c20-16-6-1-13(19(22,23)24)11-17(16)25-18(28)12-26-7-9-27(10-8-26)31(29,30)15-4-2-14(21)3-5-15/h1-6,11H,7-10,12H2,(H,25,28)

InChI Key

FMPNWPSWWZIBRT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05123246

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.88

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.006

Distribution Coefficient, logD

3.953

Water Solubility, LogSw

-4.43

Polar Surface Area

57.941

Acid Dissociation Constant (pKa)

8.29

Base Dissociation Constant (pKb)

2.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

K940-0478 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Dark Chemical Matter Library (18430 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
Structure:
  • Pool
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with K940-0478 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K940-0478?
Check Price and Availability of K940-0478, 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 K940-0478 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K940-0478
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K940-0478
  • 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 K940-0478 available by request