5340-2720 Screening compound: 5-(4-chlorophenyl)-4-(2,5-dimethoxyphenyl)-3-phenyl-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one

5340-2720 Screening compound: 5-(4-chlorophenyl)-4-(2,5-dimethoxyphenyl)-3-phenyl-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one
5340-2720 Screening compound: 5-(4-chlorophenyl)-4-(2,5-dimethoxyphenyl)-3-phenyl-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5340-2720
5-(4-chlorophenyl)-4-(2,5-dimethoxyphenyl)-3-phenyl-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-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

5340-2720

Molecular Formula

C25H20ClN3O3 (C25 H20 ClN3 O3)

Compound Name

5-(4-chlorophenyl)-4-(2,5-dimethoxyphenyl)-3-phenyl-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one

IUPAC name

5-(4-chlorophenyl)-4-(25-dimethoxyphenyl)-3-phenyl-1H4H5H6H-pyrrolo[34-c]pyrazol-6-one

SMILES

COc(cc1)cc(C(c2c(C3=O)[nH]nc2-c2ccccc2)N3c(cc2)ccc2Cl)c1OC

InChI

InChI=1S/C25H20ClN3O3/c1-31-18-12-13-20(32-2)19(14-18)24-21-22(15-6-4-3-5-7-15)27-28-23(21)25(30)29(24)17-10-8-16(26)9-11-17/h3-14,24H,1-2H3,(H,27,28)/t24-/m1/s1

InChI Key

MAXBKRXEBSSSCY-XMMPIXPASA-N

MDL Number (MFCD)

MFCD02029087

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.358

Distribution Coefficient, logD

5.358

Water Solubility, LogSw

-6.06

Polar Surface Area

54.701

Acid Dissociation Constant (pKa)

11.45

Base Dissociation Constant (pKb)

-3.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.00

5340-2720 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Targeted Diversity Library (40567 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Cancer
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with 5340-2720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5340-2720?
Check Price and Availability of 5340-2720, 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 5340-2720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5340-2720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5340-2720
  • 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 5340-2720 available by request