K405-4293 Screening compound: 1-[1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]azepane

K405-4293 Screening compound: 1-[1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]azepane
K405-4293 Screening compound: 1-[1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound K405-4293
1-[1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]azepane

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

K405-4293

Molecular Formula

C18H21N5 (C18 H21 N5)

Compound Name

1-[1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]azepane

IUPAC name

1-[1-(2-methylphenyl)-1H-pyrazolo[34-d]pyrimidin-4-yl]azepane

SMILES

Cc(cccc1)c1-n1ncc2c1ncnc2N1CCCCCC1

InChI

InChI=1S/C18H21N5/c1-14-8-4-5-9-16(14)23-18-15(12-21-23)17(19-13-20-18)22-10-6-2-3-7-11-22/h4-5,8-9,12-13H,2-3,6-7,10-11H2,1H3

InChI Key

WTJRIQRQLVQXMY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09240630

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.639

Distribution Coefficient, logD

4.635

Water Solubility, LogSw

-4.18

Polar Surface Area

37.891

Acid Dissociation Constant (pKa)

21.80

Base Dissociation Constant (pKb)

5.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

K405-4293 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with K405-4293 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K405-4293?
Check Price and Availability of K405-4293, 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 K405-4293 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K405-4293
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K405-4293
  • 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 K405-4293 available by request