F369-0401 Screening compound: 3-(3-fluorophenyl)-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

F369-0401 Screening compound: 3-(3-fluorophenyl)-4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one
F369-0401 Screening compound: 3-(3-fluorophenyl)-4-[2-(4-methylpiperidin-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 F369-0401
3-(3-fluorophenyl)-4-[2-(4-methylpiperidin-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

F369-0401

Molecular Formula

C24H22FN3O2S2 (C24 H22 FN3 O2 S2)

Compound Name

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

IUPAC name

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

SMILES

CC(CC1)CCN1C(CN(C(N1c2c3cccc2)=C(c2cc(F)ccc2)SC1=S)C3=O)=O

InChI

InChI=1S/C24H22FN3O2S2/c1-15-9-11-26(12-10-15)20(29)14-27-22-21(16-5-4-6-17(25)13-16)32-24(31)28(22)19-8-3-2-7-18(19)23(27)30/h2-8,13,15H,9-12,14H2,1H3

InChI Key

QGIOFEAHEBRFMB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27120132

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.335

Distribution Coefficient, logD

4.335

Water Solubility, LogSw

-4.35

Polar Surface Area

34.180

Acid Dissociation Constant (pKa)

25.68

Base Dissociation Constant (pKb)

4.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

F369-0401 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 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 F369-0401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F369-0401?
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What is the minimum amount of F369-0401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F369-0401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F369-0401
  • 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 F369-0401 available by request