J012-1811 Screening compound: 1-(3-chlorophenyl)-4-(3-ethoxyphenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

J012-1811 Screening compound: 1-(3-chlorophenyl)-4-(3-ethoxyphenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one
J012-1811 Screening compound: 1-(3-chlorophenyl)-4-(3-ethoxyphenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J012-1811
1-(3-chlorophenyl)-4-(3-ethoxyphenyl)-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

J012-1811

Molecular Formula

C20H18ClN3O2 (C20 H18 ClN3 O2)

Compound Name

1-(3-chlorophenyl)-4-(3-ethoxyphenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

IUPAC name

1-(3-chlorophenyl)-4-(3-ethoxyphenyl)-1H4H5H6H7H-pyrazolo[34-b]pyridin-6-one

SMILES

CCOc1cccc(C(CC(N2)=O)c3c2n(-c2cccc(Cl)c2)nc3)c1

InChI

InChI=1S/C20H18ClN3O2/c1-2-26-16-8-3-5-13(9-16)17-11-19(25)23-20-18(17)12-22-24(20)15-7-4-6-14(21)10-15/h3-10,12,17H,2,11H2,1H3,(H,23,25)/t17-/m0/s1

InChI Key

CYNGWYBPHXAJKR-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27216705

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.83

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.349

Distribution Coefficient, logD

4.349

Water Solubility, LogSw

-4.44

Polar Surface Area

45.862

Acid Dissociation Constant (pKa)

11.34

Base Dissociation Constant (pKb)

-1.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with J012-1811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J012-1811?
Check Price and Availability of J012-1811, 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 J012-1811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J012-1811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J012-1811
  • 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 J012-1811 available by request