K643-0102 Screening compound: 6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(2,4-dichlorophenyl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

K643-0102 Screening compound: 6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(2,4-dichlorophenyl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one
K643-0102 Screening compound: 6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(2,4-dichlorophenyl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K643-0102
6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(2,4-dichlorophenyl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-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

K643-0102

Molecular Formula

C18H10Cl3FN4OS (C18 H10 Cl3 FN4 OS)

Compound Name

6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(2,4-dichlorophenyl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

IUPAC name

6-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-5-(24-dichlorophenyl)-1H4H5H-pyrazolo[34-d]pyrimidin-4-one

SMILES

O=C1N(c(ccc(Cl)c2)c2Cl)C(SCc(c(F)ccc2)c2Cl)=Nc2c1cn[nH]2

InChI

InChI=1S/C18H10Cl3FN4OS/c19-9-4-5-15(13(21)6-9)26-17(27)10-7-23-25-16(10)24-18(26)28-8-11-12(20)2-1-3-14(11)22/h1-7H,8H2,(H,23,25)

InChI Key

BZVBVZZDQFLVKQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02652462

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.73

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.189

Distribution Coefficient, logD

5.187

Water Solubility, LogSw

-5.53

Polar Surface Area

49.125

Acid Dissociation Constant (pKa)

9.27

Base Dissociation Constant (pKb)

3.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

K643-0102 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K643-0102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K643-0102?
Check Price and Availability of K643-0102, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K643-0102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K643-0102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K643-0102
  • 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 K643-0102 available by request