K940-0116 Screening compound: 1-(4-bromobenzenesulfonyl)-4-[(2,6-difluorophenyl)methyl]piperazine

K940-0116 Screening compound: 1-(4-bromobenzenesulfonyl)-4-[(2,6-difluorophenyl)methyl]piperazine
K940-0116 Screening compound: 1-(4-bromobenzenesulfonyl)-4-[(2,6-difluorophenyl)methyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound K940-0116
1-(4-bromobenzenesulfonyl)-4-[(2,6-difluorophenyl)methyl]piperazine

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

K940-0116

Molecular Formula

C17H17BrF2N2O2S (C17 H17 BrF2 N2 O2 S)

Compound Name

1-(4-bromobenzenesulfonyl)-4-[(2,6-difluorophenyl)methyl]piperazine

IUPAC name

1-(4-bromobenzenesulfonyl)-4-[(26-difluorophenyl)methyl]piperazine

SMILES

O=S(c(cc1)ccc1Br)(N1CCN(Cc(c(F)ccc2)c2F)CC1)=O

InChI

InChI=1S/C17H17BrF2N2O2S/c18-13-4-6-14(7-5-13)25(23,24)22-10-8-21(9-11-22)12-15-16(19)2-1-3-17(15)20/h1-7H,8-12H2

InChI Key

AJVDWSDQAQLCNF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05030889

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.668

Distribution Coefficient, logD

3.667

Water Solubility, LogSw

-3.93

Polar Surface Area

35.490

Acid Dissociation Constant (pKa)

28.13

Base Dissociation Constant (pKb)

4.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

References: we are preparing a list of scientific research reports with K940-0116 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K940-0116?
Check Price and Availability of K940-0116, 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 K940-0116 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K940-0116
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K940-0116
  • 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 K940-0116 available by request