K643-0061 Screening compound: N-(4-chlorophenyl)-2-{[5-(2,4-dichlorophenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide

K643-0061 Screening compound: N-(4-chlorophenyl)-2-{[5-(2,4-dichlorophenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide
K643-0061 Screening compound: N-(4-chlorophenyl)-2-{[5-(2,4-dichlorophenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K643-0061
N-(4-chlorophenyl)-2-{[5-(2,4-dichlorophenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide

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

K643-0061

Molecular Formula

C19H12Cl3N5O2S (C19 H12 Cl3 N5 O2 S)

Compound Name

N-(4-chlorophenyl)-2-{[5-(2,4-dichlorophenyl)-4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl}acetamide

IUPAC name

N-(4-chlorophenyl)-2-{[5-(24-dichlorophenyl)-4-oxo-1H4H5H-pyrazolo[34-d]pyrimidin-6-yl]sulfanyl}acetamide

SMILES

O=C(CSC(N1c(ccc(Cl)c2)c2Cl)=Nc([nH]nc2)c2C1=O)Nc(cc1)ccc1Cl

InChI

InChI=1S/C19H12Cl3N5O2S/c20-10-1-4-12(5-2-10)24-16(28)9-30-19-25-17-13(8-23-26-17)18(29)27(19)15-6-3-11(21)7-14(15)22/h1-8H,9H2,(H,23,26)(H,24,28)

InChI Key

BVSXZUGORKRIOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02652444

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.76

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.432

Distribution Coefficient, logD

4.431

Water Solubility, LogSw

-4.59

Polar Surface Area

72.275

Acid Dissociation Constant (pKa)

9.27

Base Dissociation Constant (pKb)

3.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

K643-0061 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K643-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K643-0061?
Check Price and Availability of K643-0061, 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 K643-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K643-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K643-0061
  • 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 K643-0061 available by request