P590-0934 Screening compound: 2-[2-(2-furyl)-4-oxopyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]-N~1~-(2-thienylmethyl)acetamide

P590-0934 Screening compound: 2-[2-(2-furyl)-4-oxopyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]-N~1~-(2-thienylmethyl)acetamide
P590-0934 Screening compound: 2-[2-(2-furyl)-4-oxopyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]-N~1~-(2-thienylmethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P590-0934
2-[2-(2-furyl)-4-oxopyrazolo[1,5-a]pyrido[3,2-e]pyrazin-5(4H)-yl]-N~1~-(2-thienylmethyl)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

P590-0934

Molecular Formula

C20H15N5O3S (C20 H15 N5 O3 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(CN(c1c(-n(c2c3)nc3-c3ccco3)nccc1)C2=O)NCc1cccs1

InChI

InChI=1S/C20H15N5O3S/c26-18(22-11-13-4-3-9-29-13)12-24-15-5-1-7-21-19(15)25-16(20(24)27)10-14(23-25)17-6-2-8-28-17/h1-10H,11-12H2,(H,22,26)

InChI Key

QVAIBBJMROSASW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27605850

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.346

Distribution Coefficient, logD

2.346

Water Solubility, LogSw

-2.84

Polar Surface Area

71.832

Acid Dissociation Constant (pKa)

13.98

Base Dissociation Constant (pKb)

2.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

P590-0934 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 P590-0934 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P590-0934?
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What is the minimum amount of P590-0934 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P590-0934
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P590-0934
  • 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 P590-0934 available by request