K940-0449 Screening compound: 1-[(2,6-difluorophenyl)methyl]-4-(4-fluorobenzenesulfonyl)piperazine

K940-0449 Screening compound: 1-[(2,6-difluorophenyl)methyl]-4-(4-fluorobenzenesulfonyl)piperazine
K940-0449 Screening compound: 1-[(2,6-difluorophenyl)methyl]-4-(4-fluorobenzenesulfonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound K940-0449
1-[(2,6-difluorophenyl)methyl]-4-(4-fluorobenzenesulfonyl)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

K940-0449

Molecular Formula

C17H17F3N2O2S (C17 H17 F3 N2 O2 S)

Compound Name

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

IUPAC name

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

SMILES

O=S(c(cc1)ccc1F)(N1CCN(Cc(c(F)ccc2)c2F)CC1)=O

InChI

InChI=1S/C17H17F3N2O2S/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

NKLSIMDPHCKMFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05030895

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.4

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

2.863

Distribution Coefficient, logD

2.862

Water Solubility, LogSw

-3.24

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

K940-0449 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with K940-0449 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K940-0449?
Check Price and Availability of K940-0449, 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 K940-0449 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K940-0449
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K940-0449
  • 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 K940-0449 available by request