F727-0312 Screening compound: 4-[4-(2,5-difluorobenzenesulfonyl)piperazin-1-yl]-6-(3-fluorophenyl)pyrimidine

F727-0312 Screening compound: 4-[4-(2,5-difluorobenzenesulfonyl)piperazin-1-yl]-6-(3-fluorophenyl)pyrimidine
F727-0312 Screening compound: 4-[4-(2,5-difluorobenzenesulfonyl)piperazin-1-yl]-6-(3-fluorophenyl)pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound F727-0312
4-[4-(2,5-difluorobenzenesulfonyl)piperazin-1-yl]-6-(3-fluorophenyl)pyrimidine

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

F727-0312

Molecular Formula

C20H17F3N4O2S (C20 H17 F3 N4 O2 S)

Compound Name

4-[4-(2,5-difluorobenzenesulfonyl)piperazin-1-yl]-6-(3-fluorophenyl)pyrimidine

IUPAC name

4-[4-(25-difluorobenzenesulfonyl)piperazin-1-yl]-6-(3-fluorophenyl)pyrimidine

SMILES

O=S(c(cc(cc1)F)c1F)(N(CC1)CCN1c1ncnc(-c2cc(F)ccc2)c1)=O

InChI

InChI=1S/C20H17F3N4O2S/c21-15-3-1-2-14(10-15)18-12-20(25-13-24-18)26-6-8-27(9-7-26)30(28,29)19-11-16(22)4-5-17(19)23/h1-5,10-13H,6-9H2

InChI Key

FJUSJNQFJIUAJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27188543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.357

Distribution Coefficient, logD

4.355

Water Solubility, LogSw

-4.41

Polar Surface Area

54.212

Acid Dissociation Constant (pKa)

23.11

Base Dissociation Constant (pKb)

5.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

F727-0312 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with F727-0312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F727-0312?
Check Price and Availability of F727-0312, 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 F727-0312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F727-0312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F727-0312
  • 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 F727-0312 available by request