E981-1509 Screening compound: N-(2-chlorophenyl)-1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

E981-1509 Screening compound: N-(2-chlorophenyl)-1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
E981-1509 Screening compound: N-(2-chlorophenyl)-1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E981-1509
N-(2-chlorophenyl)-1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

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

E981-1509

Molecular Formula

C23H21ClN4O (C23 H21 ClN4 O)

Compound Name

N-(2-chlorophenyl)-1-(4-ethylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

IUPAC name

N-(2-chlorophenyl)-1-(4-ethylphenyl)-36-dimethyl-1H-pyrazolo[34-b]pyridine-4-carboxamide

SMILES

CCc(cc1)ccc1-n(c1nc(C)c2)nc(C)c1c2C(Nc(cccc1)c1Cl)=O

InChI

InChI=1S/C23H21ClN4O/c1-4-16-9-11-17(12-10-16)28-22-21(15(3)27-28)18(13-14(2)25-22)23(29)26-20-8-6-5-7-19(20)24/h5-13H,4H2,1-3H3,(H,26,29)

InChI Key

PJVSFJDPMIERAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14935090

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.9

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.073

Distribution Coefficient, logD

5.067

Water Solubility, LogSw

-5.20

Polar Surface Area

45.834

Acid Dissociation Constant (pKa)

9.21

Base Dissociation Constant (pKb)

1.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

E981-1509 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 E981-1509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E981-1509?
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What is the minimum amount of E981-1509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E981-1509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E981-1509
  • 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 E981-1509 available by request