F571-0431 Screening compound: 4-tert-butylphenyl 2-{[2-(4-methoxyphenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetate

F571-0431 Screening compound: 4-tert-butylphenyl 2-{[2-(4-methoxyphenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetate
F571-0431 Screening compound: 4-tert-butylphenyl 2-{[2-(4-methoxyphenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound F571-0431
4-tert-butylphenyl 2-{[2-(4-methoxyphenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetate

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

F571-0431

Molecular Formula

C24H24N4O4S (C24 H24 N4 O4 S)

Compound Name

4-tert-butylphenyl 2-{[2-(4-methoxyphenyl)-7-oxo-6H,7H-pyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}acetate

IUPAC name

4-tert-butylphenyl 2-{[2-(4-methoxyphenyl)-7-oxo-6H7H-pyrazolo[15-a][135]triazin-4-yl]sulfanyl}acetate

SMILES

CC(C)(C)c(cc1)ccc1OC(CSC(N1N2)=NC(c(cc3)ccc3OC)=NC1=CC2=O)=O

InChI

InChI=1S/C24H24N4O4S/c1-24(2,3)16-7-11-18(12-8-16)32-21(30)14-33-23-26-22(15-5-9-17(31-4)10-6-15)25-19-13-20(29)27-28(19)23/h5-13H,14H2,1-4H3,(H,27,29)

InChI Key

HLGVTEOEOVHXBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27176451

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.776

Distribution Coefficient, logD

4.776

Water Solubility, LogSw

-4.51

Polar Surface Area

77.531

Acid Dissociation Constant (pKa)

13.28

Base Dissociation Constant (pKb)

-0.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

F571-0431 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F571-0431 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F571-0431?
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What is the minimum amount of F571-0431 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F571-0431
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F571-0431
  • 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 F571-0431 available by request