F424-1147 Screening compound: 2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

F424-1147 Screening compound: 2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
F424-1147 Screening compound: 2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F424-1147
2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}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

F424-1147

Molecular Formula

C23H23N5O4S2 (C23 H23 N5 O4 S2)

Compound Name

2-{[2-(3,4-dimethoxyphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

IUPAC name

2-{[2-(34-dimethoxyphenyl)-4-oxo-4H5H-pyrazolo[15-d][124]triazin-7-yl]sulfanyl}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide

SMILES

COc(ccc(-c(cc12)nn1C(SCC(NCc(cc1)ccc1SC)=O)=NNC2=O)c1)c1OC

InChI

InChI=1S/C23H23N5O4S2/c1-31-19-9-6-15(10-20(19)32-2)17-11-18-22(30)25-26-23(28(18)27-17)34-13-21(29)24-12-14-4-7-16(33-3)8-5-14/h4-11H,12-13H2,1-3H3,(H,24,29)(H,25,30)

InChI Key

LIBBWIWMJUQMBE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16639276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.6

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.388

Distribution Coefficient, logD

3.386

Water Solubility, LogSw

-3.85

Polar Surface Area

91.047

Acid Dissociation Constant (pKa)

9.85

Base Dissociation Constant (pKb)

3.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

F424-1147 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

CORONAVIRUS Library (20774 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with F424-1147 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F424-1147?
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What is the minimum amount of F424-1147 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F424-1147
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F424-1147
  • 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 F424-1147 available by request