F369-0589 Screening compound: 2-[3-(3-fluorophenyl)-5-oxo-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-4-yl]-N-propylacetamide

F369-0589 Screening compound: 2-[3-(3-fluorophenyl)-5-oxo-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-4-yl]-N-propylacetamide
F369-0589 Screening compound: 2-[3-(3-fluorophenyl)-5-oxo-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-4-yl]-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F369-0589
2-[3-(3-fluorophenyl)-5-oxo-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-4-yl]-N-propylacetamide

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

F369-0589

Molecular Formula

C21H18FN3O2S2 (C21 H18 FN3 O2 S2)

Compound Name

2-[3-(3-fluorophenyl)-5-oxo-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-4-yl]-N-propylacetamide

IUPAC name

2-[3-(3-fluorophenyl)-5-oxo-1-sulfanylidene-1H4H5H-[13]thiazolo[34-a]quinazolin-4-yl]-N-propylacetamide

SMILES

CCCNC(CN(C(N1c2c3cccc2)=C(c2cc(F)ccc2)SC1=S)C3=O)=O

InChI

InChI=1S/C21H18FN3O2S2/c1-2-10-23-17(26)12-24-19-18(13-6-5-7-14(22)11-13)29-21(28)25(19)16-9-4-3-8-15(16)20(24)27/h3-9,11H,2,10,12H2,1H3,(H,23,26)

InChI Key

WBWRJJVIZYOTBI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27120151

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.720

Distribution Coefficient, logD

3.720

Water Solubility, LogSw

-4.04

Polar Surface Area

42.373

Acid Dissociation Constant (pKa)

16.19

Base Dissociation Constant (pKb)

1.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

F369-0589 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with F369-0589 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F369-0589?
Check Price and Availability of F369-0589, 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 F369-0589 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F369-0589
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F369-0589
  • 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 F369-0589 available by request