K286-2016 Screening compound: 6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

K286-2016 Screening compound: 6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one
K286-2016 Screening compound: 6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K286-2016
6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-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

K286-2016

Molecular Formula

C27H28N4O3S3 (C27 H28 N4 O3 S3)

Compound Name

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

IUPAC name

6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-5-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-7-one

SMILES

CCc(cc1)ccc1N(C(N=C(N(c(cc1)ccc1OCC)C1=O)SCC(N2CCCC2)=O)=C1S1)C1=S

InChI

InChI=1S/C27H28N4O3S3/c1-3-18-7-9-19(10-8-18)30-24-23(37-27(30)35)25(33)31(20-11-13-21(14-12-20)34-4-2)26(28-24)36-17-22(32)29-15-5-6-16-29/h7-14H,3-6,15-17H2,1-2H3

InChI Key

ZFIZVASKQOCSOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15090379

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

552.74

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.251

Distribution Coefficient, logD

5.251

Water Solubility, LogSw

-4.93

Polar Surface Area

50.837

Acid Dissociation Constant (pKa)

26.44

Base Dissociation Constant (pKb)

-9.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

K286-2016 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 K286-2016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K286-2016?
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What is the minimum amount of K286-2016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K286-2016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K286-2016
  • 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 K286-2016 available by request