F589-0032 Screening compound: 4-[(4-{1-[(4-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}piperidin-1-yl)sulfonyl]-2,1,3-benzothiadiazole

F589-0032 Screening compound: 4-[(4-{1-[(4-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}piperidin-1-yl)sulfonyl]-2,1,3-benzothiadiazole
F589-0032 Screening compound: 4-[(4-{1-[(4-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}piperidin-1-yl)sulfonyl]-2,1,3-benzothiadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound F589-0032
4-[(4-{1-[(4-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}piperidin-1-yl)sulfonyl]-2,1,3-benzothiadiazole

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

F589-0032

Molecular Formula

C27H25FN4O2S2 (C27 H25 FN4 O2 S2)

Compound Name

4-[(4-{1-[(4-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}piperidin-1-yl)sulfonyl]-2,1,3-benzothiadiazole

IUPAC name

4-[(4-{1-[(4-fluorophenyl)methyl]-2-methyl-1H-indol-3-yl}piperidin-1-yl)sulfonyl]-213-benzothiadiazole

SMILES

Cc1c(C(CC2)CCN2S(c2cccc3nsnc23)(=O)=O)c(cccc2)c2n1Cc(cc1)ccc1F

InChI

InChI=1S/C27H25FN4O2S2/c1-18-26(22-5-2-3-7-24(22)32(18)17-19-9-11-21(28)12-10-19)20-13-15-31(16-14-20)36(33,34)25-8-4-6-23-27(25)30-35-29-23/h2-12,20H,13-17H2,1H3

InChI Key

GSFNLKKCTXUFTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14960147

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.65

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.863

Distribution Coefficient, logD

5.863

Water Solubility, LogSw

-5.90

Polar Surface Area

53.831

Acid Dissociation Constant (pKa)

24.58

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

F589-0032 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F589-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F589-0032?
Check Price and Availability of F589-0032, 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 F589-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F589-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F589-0032
  • 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 F589-0032 available by request