F369-0498 Screening compound: 4-[(3-fluoro-4-methoxyphenyl)methyl]-3-(4-fluorophenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

F369-0498 Screening compound: 4-[(3-fluoro-4-methoxyphenyl)methyl]-3-(4-fluorophenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one
F369-0498 Screening compound: 4-[(3-fluoro-4-methoxyphenyl)methyl]-3-(4-fluorophenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F369-0498
4-[(3-fluoro-4-methoxyphenyl)methyl]-3-(4-fluorophenyl)-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

F369-0498

Molecular Formula

C24H16F2N2O2S2 (C24 H16 F2 N2 O2 S2)

Compound Name

4-[(3-fluoro-4-methoxyphenyl)methyl]-3-(4-fluorophenyl)-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

IUPAC name

4-[(3-fluoro-4-methoxyphenyl)methyl]-3-(4-fluorophenyl)-1-sulfanylidene-1H4H5H-[13]thiazolo[34-a]quinazolin-5-one

SMILES

COc(ccc(CN(C(N1c2c3cccc2)=C(c(cc2)ccc2F)SC1=S)C3=O)c1)c1F

InChI

InChI=1S/C24H16F2N2O2S2/c1-30-20-11-6-14(12-18(20)26)13-27-22-21(15-7-9-16(25)10-8-15)32-24(31)28(22)19-5-3-2-4-17(19)23(27)29/h2-12H,13H2,1H3

InChI Key

SPFNIEMSJQINBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14952155

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.53

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

5.601

Distribution Coefficient, logD

5.601

Water Solubility, LogSw

-5.42

Polar Surface Area

25.418

Acid Dissociation Constant (pKa)

29.83

Base Dissociation Constant (pKb)

-5.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

F369-0498 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F369-0498 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F369-0498?
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What is the minimum amount of F369-0498 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F369-0498
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F369-0498
  • 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 F369-0498 available by request