E568-0060 Screening compound: 1-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]-4-methylpiperidine

E568-0060 Screening compound: 1-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]-4-methylpiperidine
E568-0060 Screening compound: 1-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]-4-methylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound E568-0060
1-[3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]-4-methylpiperidine

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

E568-0060

Molecular Formula

C22H26N4O (C22 H26 N4 O)

Compound Name

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

IUPAC name

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

SMILES

CC(CC1)CCN1C(c1c(c(C)nn2-c3ccc(C)cc3)c2nc(C)c1)=O

InChI

InChI=1S/C22H26N4O/c1-14-5-7-18(8-6-14)26-21-20(17(4)24-26)19(13-16(3)23-21)22(27)25-11-9-15(2)10-12-25/h5-8,13,15H,9-12H2,1-4H3

InChI Key

BSMRGBUDKHXXQQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14899124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.870

Distribution Coefficient, logD

3.870

Water Solubility, LogSw

-3.95

Polar Surface Area

40.089

Acid Dissociation Constant (pKa)

26.31

Base Dissociation Constant (pKb)

3.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

E568-0060 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

Protein-Protein Interaction Library (218420 compounds)

Purinergic Library (3321 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Nervous system
  • Cardiovascular
  • Metabolic
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with E568-0060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E568-0060?
Check Price and Availability of E568-0060, 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 E568-0060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E568-0060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E568-0060
  • 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 E568-0060 available by request