C085-0276 Screening compound: 1-(3-chlorophenyl)-4-(4-fluorobenzenesulfonyl)piperazine

C085-0276 Screening compound: 1-(3-chlorophenyl)-4-(4-fluorobenzenesulfonyl)piperazine
C085-0276 Screening compound: 1-(3-chlorophenyl)-4-(4-fluorobenzenesulfonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C085-0276
1-(3-chlorophenyl)-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

C085-0276

Molecular Formula

C16H16ClFN2O2S (C16 H16 ClFN2 O2 S)

Compound Name

1-(3-chlorophenyl)-4-(4-fluorobenzenesulfonyl)piperazine

IUPAC name

1-(3-chlorophenyl)-4-(4-fluorobenzenesulfonyl)piperazine

SMILES

O=S(c(cc1)ccc1F)(N(CC1)CCN1c1cccc(Cl)c1)=O

InChI

InChI=1S/C16H16ClFN2O2S/c17-13-2-1-3-15(12-13)19-8-10-20(11-9-19)23(21,22)16-6-4-14(18)5-7-16/h1-7,12H,8-11H2

InChI Key

TUQPROCBKUHJGY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00784426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.621

Distribution Coefficient, logD

3.621

Water Solubility, LogSw

-3.78

Polar Surface Area

35.210

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

1.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C085-0276 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C085-0276 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C085-0276?
Check Price and Availability of C085-0276, 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 C085-0276 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C085-0276
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C085-0276
  • 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 C085-0276 available by request