E981-1719 Screening compound: 1-(3-chlorophenyl)-4-[1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine

E981-1719 Screening compound: 1-(3-chlorophenyl)-4-[1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine
E981-1719 Screening compound: 1-(3-chlorophenyl)-4-[1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E981-1719
1-(3-chlorophenyl)-4-[1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]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

E981-1719

Molecular Formula

C27H28ClN5O (C27 H28 ClN5 O)

Compound Name

1-(3-chlorophenyl)-4-[1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbonyl]piperazine

IUPAC name

1-(3-chlorophenyl)-4-[1-(4-ethylphenyl)-36-dimethyl-1H-pyrazolo[34-b]pyridine-4-carbonyl]piperazine

SMILES

CCc(cc1)ccc1-n(c1nc(C)c2)nc(C)c1c2C(N(CC1)CCN1c1cccc(Cl)c1)=O

InChI

InChI=1S/C27H28ClN5O/c1-4-20-8-10-22(11-9-20)33-26-25(19(3)30-33)24(16-18(2)29-26)27(34)32-14-12-31(13-15-32)23-7-5-6-21(28)17-23/h5-11,16-17H,4,12-15H2,1-3H3

InChI Key

NYCUUIHETQWBQO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14935153

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.01

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.266

Distribution Coefficient, logD

5.266

Water Solubility, LogSw

-5.62

Polar Surface Area

43.349

Acid Dissociation Constant (pKa)

26.01

Base Dissociation Constant (pKb)

3.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

E981-1719 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with E981-1719 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E981-1719?
Check Price and Availability of E981-1719, 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 E981-1719 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E981-1719
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E981-1719
  • 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 E981-1719 available by request