P590-0563 Screening compound: N~1~-(2,4-difluorophenyl)-2-[2-(2-furyl)-4-oxopyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]acetamide

P590-0563 Screening compound: N~1~-(2,4-difluorophenyl)-2-[2-(2-furyl)-4-oxopyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]acetamide
P590-0563 Screening compound: N~1~-(2,4-difluorophenyl)-2-[2-(2-furyl)-4-oxopyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P590-0563
N~1~-(2,4-difluorophenyl)-2-[2-(2-furyl)-4-oxopyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]acetamide

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

P590-0563

Molecular Formula

C21H13F2N5O3 (C21 H13 F2 N5 O3)

Compound Name

N~1~-(2,4-difluorophenyl)-2-[2-(2-furyl)-4-oxopyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]acetamide

IUPAC name

N-(24-difluorophenyl)-2-[4-(furan-2-yl)-7-oxo-23813-tetraazatricyclo[7.4.0.0^{26}]trideca-1(13)35911-pentaen-8-yl]acetamide

SMILES

O=C(CN(c1c(-n(c2c3)nc3-c3ccco3)nccc1)C2=O)Nc(ccc(F)c1)c1F

InChI

InChI=1S/C21H13F2N5O3/c22-12-5-6-14(13(23)9-12)25-19(29)11-27-16-3-1-7-24-20(16)28-17(21(27)30)10-15(26-28)18-4-2-8-31-18/h1-10H,11H2,(H,25,29)

InChI Key

BNBPFIYHXQCAMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27605802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.709

Distribution Coefficient, logD

2.698

Water Solubility, LogSw

-3.05

Polar Surface Area

68.794

Acid Dissociation Constant (pKa)

9.00

Base Dissociation Constant (pKb)

2.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

P590-0563 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with P590-0563 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P590-0563?
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What is the minimum amount of P590-0563 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P590-0563
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P590-0563
  • 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 P590-0563 available by request