F092-0202 Screening compound: 2-{[3-(4-chlorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide

F092-0202 Screening compound: 2-{[3-(4-chlorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide
F092-0202 Screening compound: 2-{[3-(4-chlorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F092-0202
2-{[3-(4-chlorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide

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

F092-0202

Molecular Formula

C19H11ClF2N4O2S3 (C19 H11 ClF2 N4 O2 S3)

Compound Name

2-{[3-(4-chlorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3,4-difluorophenyl)acetamide

IUPAC name

2-{[3-(4-chlorophenyl)-7-oxo-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-5-yl]sulfanyl}-N-(34-difluorophenyl)acetamide

SMILES

O=C(CSC(NC1=O)=NC(N2c(cc3)ccc3Cl)=C1SC2=S)Nc(cc1)cc(F)c1F

InChI

InChI=1S/C19H11ClF2N4O2S3/c20-9-1-4-11(5-2-9)26-16-15(31-19(26)29)17(28)25-18(24-16)30-8-14(27)23-10-3-6-12(21)13(22)7-10/h1-7H,8H2,(H,23,27)(H,24,25,28)

InChI Key

JOHLYJCVBPAKHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14941065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.237

Distribution Coefficient, logD

4.232

Water Solubility, LogSw

-4.60

Polar Surface Area

59.445

Acid Dissociation Constant (pKa)

9.34

Base Dissociation Constant (pKb)

-4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

F092-0202 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 F092-0202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F092-0202?
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What is the minimum amount of F092-0202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F092-0202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F092-0202
  • 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 F092-0202 available by request