K405-4179 Screening compound: 1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-(4-fluorophenyl)piperazine

K405-4179 Screening compound: 1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-(4-fluorophenyl)piperazine
K405-4179 Screening compound: 1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-(4-fluorophenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound K405-4179
1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-(4-fluorophenyl)piperazine

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

K405-4179

Molecular Formula

C21H18ClFN6 (C21 H18 ClFN6)

Compound Name

1-[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-4-(4-fluorophenyl)piperazine

IUPAC name

1-[1-(4-chlorophenyl)-1H-pyrazolo[34-d]pyrimidin-4-yl]-4-(4-fluorophenyl)piperazine

SMILES

Fc(cc1)ccc1N(CC1)CCN1c1c(cnn2-c(cc3)ccc3Cl)c2ncn1

InChI

InChI=1S/C21H18ClFN6/c22-15-1-5-18(6-2-15)29-21-19(13-26-29)20(24-14-25-21)28-11-9-27(10-12-28)17-7-3-16(23)4-8-17/h1-8,13-14H,9-12H2

InChI Key

SJTOHXMRNGIAMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02651953

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.87

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

5.139

Distribution Coefficient, logD

5.138

Water Solubility, LogSw

-5.79

Polar Surface Area

41.121

Acid Dissociation Constant (pKa)

21.21

Base Dissociation Constant (pKb)

4.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

K405-4179 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with K405-4179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K405-4179?
Check Price and Availability of K405-4179, 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 K405-4179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K405-4179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K405-4179
  • 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 K405-4179 available by request