K286-0173 Screening compound: ethyl 4-({6-[(furan-2-yl)methyl]-3-(2-methoxyphenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)-3-oxobutanoate

K286-0173 Screening compound: ethyl 4-({6-[(furan-2-yl)methyl]-3-(2-methoxyphenyl)-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl}sulfanyl)-3-oxobutanoate
K286-0173 Screening compound: ethyl 4-({6-[(furan-2-yl)methyl]-3-(2-methoxyphenyl)-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 K286-0173
ethyl 4-({6-[(furan-2-yl)methyl]-3-(2-methoxyphenyl)-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

K286-0173

Molecular Formula

C23H21N3O6S3 (C23 H21 N3 O6 S3)

Compound Name

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

IUPAC name

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

SMILES

CCOC(CC(CSC(N(Cc1ccco1)C1=O)=NC(N2c(cccc3)c3OC)=C1SC2=S)=O)=O

InChI

InChI=1S/C23H21N3O6S3/c1-3-31-18(28)11-14(27)13-34-22-24-20-19(21(29)25(22)12-15-7-6-10-32-15)35-23(33)26(20)16-8-4-5-9-17(16)30-2/h4-10H,3,11-13H2,1-2H3

InChI Key

HQPGVCZKDDRGTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05023500

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

531.63

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.294

Distribution Coefficient, logD

3.294

Water Solubility, LogSw

-3.56

Polar Surface Area

75.830

Acid Dissociation Constant (pKa)

11.31

Base Dissociation Constant (pKb)

-3.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

K286-0173 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 K286-0173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K286-0173?
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What is the minimum amount of K286-0173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K286-0173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K286-0173
  • 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 K286-0173 available by request