K402-0198 Screening compound: N-[4-(4-chlorophenoxy)phenyl]-1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

K402-0198 Screening compound: N-[4-(4-chlorophenoxy)phenyl]-1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
K402-0198 Screening compound: N-[4-(4-chlorophenoxy)phenyl]-1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound K402-0198
N-[4-(4-chlorophenoxy)phenyl]-1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

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

K402-0198

Molecular Formula

C23H15Cl2N5O (C23 H15 Cl2 N5 O)

Compound Name

N-[4-(4-chlorophenoxy)phenyl]-1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

IUPAC name

N-[4-(4-chlorophenoxy)phenyl]-1-(4-chlorophenyl)-1H-pyrazolo[34-d]pyrimidin-4-amine

SMILES

Clc(cc1)ccc1-n1ncc2c1ncnc2Nc(cc1)ccc1Oc(cc1)ccc1Cl

InChI

InChI=1S/C23H15Cl2N5O/c24-15-1-7-18(8-2-15)30-23-21(13-28-30)22(26-14-27-23)29-17-5-11-20(12-6-17)31-19-9-3-16(25)4-10-19/h1-14H,(H,26,27,29)

InChI Key

QLDMDQRQYLFQTP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03474903

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.977

Distribution Coefficient, logD

6.977

Water Solubility, LogSw

-6.90

Polar Surface Area

50.775

Acid Dissociation Constant (pKa)

17.75

Base Dissociation Constant (pKb)

3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

K402-0198 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

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 K402-0198 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K402-0198?
Check Price and Availability of K402-0198, 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 K402-0198 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K402-0198
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K402-0198
  • 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 K402-0198 available by request