F369-0059 Screening compound: 3-(4-fluorophenyl)-4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

F369-0059 Screening compound: 3-(4-fluorophenyl)-4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one
F369-0059 Screening compound: 3-(4-fluorophenyl)-4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F369-0059
3-(4-fluorophenyl)-4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

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

F369-0059

Molecular Formula

C28H22F2N4O2S2 (C28 H22 F2 N4 O2 S2)

Compound Name

3-(4-fluorophenyl)-4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

IUPAC name

3-(4-fluorophenyl)-4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-1-sulfanylidene-1H4H5H-[13]thiazolo[34-a]quinazolin-5-one

SMILES

O=C(CN(C(N1c2c3cccc2)=C(c(cc2)ccc2F)SC1=S)C3=O)N(CC1)CCN1c(cc1)ccc1F

InChI

InChI=1S/C28H22F2N4O2S2/c29-19-7-5-18(6-8-19)25-26-33(27(36)22-3-1-2-4-23(22)34(26)28(37)38-25)17-24(35)32-15-13-31(14-16-32)21-11-9-20(30)10-12-21/h1-12H,13-17H2

InChI Key

UZXZRMDDBUFEGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14952041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

548.64

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

4.761

Distribution Coefficient, logD

4.761

Water Solubility, LogSw

-4.72

Polar Surface Area

37.441

Acid Dissociation Constant (pKa)

25.68

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

F369-0059 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with F369-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F369-0059?
Check Price and Availability of F369-0059, 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 F369-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F369-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F369-0059
  • 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 F369-0059 available by request