S553-0280 Screening compound: 2-(3-chlorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-4-one

S553-0280 Screening compound: 2-(3-chlorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-4-one
S553-0280 Screening compound: 2-(3-chlorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S553-0280
2-(3-chlorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-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

S553-0280

Molecular Formula

C12H8ClN3O (C12 H8 ClN3 O)

Compound Name

2-(3-chlorophenyl)-4H,5H-pyrazolo[1,5-a]pyrazin-4-one

IUPAC name

2-(3-chlorophenyl)-4H5H-pyrazolo[15-a]pyrazin-4-one

SMILES

O=C(c1c2)NC=Cn1nc2-c1cccc(Cl)c1

InChI

InChI=1S/C12H8ClN3O/c13-9-3-1-2-8(6-9)10-7-11-12(17)14-4-5-16(11)15-10/h1-7H,(H,14,17)

InChI Key

JNPHDXABGRZHHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22391003

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

245.67

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.693

Distribution Coefficient, logD

1.692

Water Solubility, LogSw

-2.57

Polar Surface Area

37.184

Acid Dissociation Constant (pKa)

10.39

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

S553-0280 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
  • Eye
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Structure:
  • Fragments
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with S553-0280 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S553-0280?
Check Price and Availability of S553-0280, 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 S553-0280 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S553-0280
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S553-0280
  • 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 S553-0280 available by request