K402-0669 Screening compound: 1-[1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-phenylpiperazine

K402-0669 Screening compound: 1-[1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-phenylpiperazine
K402-0669 Screening compound: 1-[1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound K402-0669
1-[1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-phenylpiperazine

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

K402-0669

Molecular Formula

C22H22N6 (C22 H22 N6)

Compound Name

1-[1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-phenylpiperazine

IUPAC name

1-[1-(3-methylphenyl)-1H-pyrazolo[34-d]pyrimidin-4-yl]-4-phenylpiperazine

SMILES

Cc1cccc(-n2ncc3c2ncnc3N(CC2)CCN2c2ccccc2)c1

InChI

InChI=1S/C22H22N6/c1-17-6-5-9-19(14-17)28-22-20(15-25-28)21(23-16-24-22)27-12-10-26(11-13-27)18-7-3-2-4-8-18/h2-9,14-16H,10-13H2,1H3

InChI Key

NLMQJLGRHRCODM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02651942

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.887

Distribution Coefficient, logD

4.879

Water Solubility, LogSw

-4.65

Polar Surface Area

41.121

Acid Dissociation Constant (pKa)

21.21

Base Dissociation Constant (pKb)

5.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

K402-0669 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

Human Proteases Annotated Library (2868 compounds)

STING Agonist Library (5895 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with K402-0669 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K402-0669?
Check Price and Availability of K402-0669, 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 K402-0669 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K402-0669
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K402-0669
  • 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 K402-0669 available by request