3760-0059 Screening compound: 5-(3-chlorophenyl)-1-phenyl-6-(thiophen-2-yl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

3760-0059 Screening compound: 5-(3-chlorophenyl)-1-phenyl-6-(thiophen-2-yl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one
3760-0059 Screening compound: 5-(3-chlorophenyl)-1-phenyl-6-(thiophen-2-yl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3760-0059
5-(3-chlorophenyl)-1-phenyl-6-(thiophen-2-yl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-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

3760-0059

Molecular Formula

C21H13ClN4OS (C21 H13 ClN4 OS)

Compound Name

5-(3-chlorophenyl)-1-phenyl-6-(thiophen-2-yl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

IUPAC name

5-(3-chlorophenyl)-1-phenyl-6-(thiophen-2-yl)-1H4H5H-pyrazolo[34-d]pyrimidin-4-one

SMILES

O=C1N(c2cccc(Cl)c2)C(c2cccs2)=Nc2c1cnn2-c1ccccc1

InChI

InChI=1S/C21H13ClN4OS/c22-14-6-4-9-16(12-14)25-20(18-10-5-11-28-18)24-19-17(21(25)27)13-23-26(19)15-7-2-1-3-8-15/h1-13H

InChI Key

KRJXVXQUSNDVBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02916904

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.88

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

4.988

Distribution Coefficient, logD

4.982

Water Solubility, LogSw

-5.05

Polar Surface Area

39.707

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

5.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3760-0059 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Antiviral Library (67538 compounds)

CNS targets activity set (6557 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
Targets:
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3760-0059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3760-0059?
Check Price and Availability of 3760-0059, 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 3760-0059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3760-0059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3760-0059
  • 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 3760-0059 available by request