K286-4105 Screening compound: 5-(butylsulfanyl)-3-(2-methylphenyl)-6-phenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one

K286-4105 Screening compound: 5-(butylsulfanyl)-3-(2-methylphenyl)-6-phenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
K286-4105 Screening compound: 5-(butylsulfanyl)-3-(2-methylphenyl)-6-phenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K286-4105
5-(butylsulfanyl)-3-(2-methylphenyl)-6-phenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-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

K286-4105

Molecular Formula

C22H21N3OS3 (C22 H21 N3 OS3)

Compound Name

5-(butylsulfanyl)-3-(2-methylphenyl)-6-phenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one

IUPAC name

5-(butylsulfanyl)-3-(2-methylphenyl)-6-phenyl-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-7-one

SMILES

CCCCSC(N(c1ccccc1)C1=O)=NC(N2c3c(C)cccc3)=C1SC2=S

InChI

InChI=1S/C22H21N3OS3/c1-3-4-14-28-21-23-19-18(20(26)24(21)16-11-6-5-7-12-16)29-22(27)25(19)17-13-9-8-10-15(17)2/h5-13H,3-4,14H2,1-2H3

InChI Key

ZCMYAPUALOYBGV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15090959

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.63

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.857

Distribution Coefficient, logD

5.857

Water Solubility, LogSw

-5.41

Polar Surface Area

26.925

Acid Dissociation Constant (pKa)

28.32

Base Dissociation Constant (pKb)

0.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.73

K286-4105 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with K286-4105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K286-4105?
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What is the minimum amount of K286-4105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K286-4105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K286-4105
  • 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 K286-4105 available by request