K940-0202 Screening compound: 1-[4-(4-bromobenzenesulfonyl)piperazin-1-yl]-2-phenoxyethan-1-one

K940-0202 Screening compound: 1-[4-(4-bromobenzenesulfonyl)piperazin-1-yl]-2-phenoxyethan-1-one
K940-0202 Screening compound: 1-[4-(4-bromobenzenesulfonyl)piperazin-1-yl]-2-phenoxyethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K940-0202
1-[4-(4-bromobenzenesulfonyl)piperazin-1-yl]-2-phenoxyethan-1-one

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

K940-0202

Molecular Formula

C18H19BrN2O4S (C18 H19 BrN2 O4 S)

Compound Name

1-[4-(4-bromobenzenesulfonyl)piperazin-1-yl]-2-phenoxyethan-1-one

IUPAC name

1-[4-(4-bromobenzenesulfonyl)piperazin-1-yl]-2-phenoxyethan-1-one

SMILES

O=C(COc1ccccc1)N(CC1)CCN1S(c(cc1)ccc1Br)(=O)=O

InChI

InChI=1S/C18H19BrN2O4S/c19-15-6-8-17(9-7-15)26(23,24)21-12-10-20(11-13-21)18(22)14-25-16-4-2-1-3-5-16/h1-9H,10-14H2

InChI Key

AAYXDYDDZQAOSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07263203

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.33

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.751

Distribution Coefficient, logD

2.751

Water Solubility, LogSw

-3.10

Polar Surface Area

55.377

Acid Dissociation Constant (pKa)

25.23

Base Dissociation Constant (pKb)

-2.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

K940-0202 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
Targets:
  • Proteases
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K940-0202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K940-0202?
Check Price and Availability of K940-0202, 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 K940-0202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K940-0202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K940-0202
  • 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 K940-0202 available by request