J013-1783 Screening compound: 4-(2H-1,3-benzodioxole-5-carbonyl)-3-phenyl-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

J013-1783 Screening compound: 4-(2H-1,3-benzodioxole-5-carbonyl)-3-phenyl-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one
J013-1783 Screening compound: 4-(2H-1,3-benzodioxole-5-carbonyl)-3-phenyl-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J013-1783
4-(2H-1,3-benzodioxole-5-carbonyl)-3-phenyl-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

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

J013-1783

Molecular Formula

C20H15N3O4 (C20 H15 N3 O4)

Compound Name

4-(2H-1,3-benzodioxole-5-carbonyl)-3-phenyl-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

IUPAC name

4-(2H-13-benzodioxole-5-carbonyl)-3-phenyl-1H4H5H6H7H-pyrazolo[34-b]pyridin-6-one

SMILES

O=C(C(C1)c(c(-c2ccccc2)n[nH]2)c2NC1=O)c(cc1)cc2c1OCO2

InChI

InChI=1S/C20H15N3O4/c24-16-9-13(19(25)12-6-7-14-15(8-12)27-10-26-14)17-18(22-23-20(17)21-16)11-4-2-1-3-5-11/h1-8,13H,9-10H2,(H2,21,22,23,24)/t13-/m0/s1

InChI Key

KVEHMNVIIFHZIF-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD27217265

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.452

Distribution Coefficient, logD

2.393

Water Solubility, LogSw

-3.15

Polar Surface Area

79.478

Acid Dissociation Constant (pKa)

8.23

Base Dissociation Constant (pKb)

-3.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.00

J013-1783 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Proteases
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with J013-1783 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J013-1783?
Check Price and Availability of J013-1783, 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 J013-1783 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J013-1783
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J013-1783
  • 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 J013-1783 available by request