K286-3221 Screening compound: ethyl 4-{[3-(2-fluorophenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-3-oxobutanoate

K286-3221 Screening compound: ethyl 4-{[3-(2-fluorophenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-3-oxobutanoate
K286-3221 Screening compound: ethyl 4-{[3-(2-fluorophenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-3-oxobutanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound K286-3221
ethyl 4-{[3-(2-fluorophenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-3-oxobutanoate

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

K286-3221

Molecular Formula

C23H17F2N3O4S3 (C23 H17 F2 N3 O4 S3)

Compound Name

ethyl 4-{[3-(2-fluorophenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-3-oxobutanoate

IUPAC name

ethyl 4-{[3-(2-fluorophenyl)-6-(4-fluorophenyl)-7-oxo-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-5-yl]sulfanyl}-3-oxobutanoate

SMILES

CCOC(CC(CSC(N(c(cc1)ccc1F)C1=O)=NC(N2c(cccc3)c3F)=C1SC2=S)=O)=O

InChI

InChI=1S/C23H17F2N3O4S3/c1-2-32-18(30)11-15(29)12-34-22-26-20-19(21(31)27(22)14-9-7-13(24)8-10-14)35-23(33)28(20)17-6-4-3-5-16(17)25/h3-10H,2,11-12H2,1H3

InChI Key

VNPXSNVXNVZEKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15090471

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.6

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.786

Distribution Coefficient, logD

3.785

Water Solubility, LogSw

-4.01

Polar Surface Area

59.839

Acid Dissociation Constant (pKa)

11.31

Base Dissociation Constant (pKb)

-0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

K286-3221 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with K286-3221 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K286-3221?
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What is the minimum amount of K286-3221 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K286-3221
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K286-3221
  • 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 K286-3221 available by request