E568-0064 Screening compound: 1-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]-4-phenylpiperazine

E568-0064 Screening compound: 1-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]-4-phenylpiperazine
E568-0064 Screening compound: 1-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E568-0064
1-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]-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

E568-0064

Molecular Formula

C26H27N5O (C26 H27 N5 O)

Compound Name

1-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]-4-phenylpiperazine

IUPAC name

1-[36-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[34-b]pyridine-4-carbonyl]-4-phenylpiperazine

SMILES

Cc(c(c1nc(C)c2)c2C(N(CC2)CCN2c2ccccc2)=O)nn1-c1ccc(C)cc1

InChI

InChI=1S/C26H27N5O/c1-18-9-11-22(12-10-18)31-25-24(20(3)28-31)23(17-19(2)27-25)26(32)30-15-13-29(14-16-30)21-7-5-4-6-8-21/h4-12,17H,13-16H2,1-3H3

InChI Key

XXLSBBQQCUOIFR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14899125

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.175

Distribution Coefficient, logD

4.175

Water Solubility, LogSw

-4.37

Polar Surface Area

43.349

Acid Dissociation Constant (pKa)

27.42

Base Dissociation Constant (pKb)

3.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

E568-0064 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with E568-0064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E568-0064?
Check Price and Availability of E568-0064, 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 E568-0064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E568-0064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E568-0064
  • 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 E568-0064 available by request