F369-0122 Screening compound: 4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3-phenyl-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one

F369-0122 Screening compound: 4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3-phenyl-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one
F369-0122 Screening compound: 4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3-phenyl-1-sulfanylidene-1H,4H,5H-[1,3]thiazolo[3,4-a]quinazolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F369-0122
4-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-3-phenyl-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

F369-0122

Molecular Formula

C28H23FN4O2S2 (C28 H23 FN4 O2 S2)

Compound Name

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

IUPAC name

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

SMILES

O=C(CN(C(N1c2c3cccc2)=C(c2ccccc2)SC1=S)C3=O)N(CC1)CCN1c(cc1)ccc1F

InChI

InChI=1S/C28H23FN4O2S2/c29-20-10-12-21(13-11-20)30-14-16-31(17-15-30)24(34)18-32-26-25(19-6-2-1-3-7-19)37-28(36)33(26)23-9-5-4-8-22(23)27(32)35/h1-13H,14-18H2

InChI Key

KXPSKINHAPEDDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14952060

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

530.65

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

4.627

Distribution Coefficient, logD

4.627

Water Solubility, LogSw

-4.57

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

F369-0122 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 F369-0122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F369-0122?
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What is the minimum amount of F369-0122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F369-0122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F369-0122
  • 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 F369-0122 available by request