G339-0852 Screening compound: 1-[(3-methoxyphenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-indazole-6-carboxamide

G339-0852 Screening compound: 1-[(3-methoxyphenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-indazole-6-carboxamide
G339-0852 Screening compound: 1-[(3-methoxyphenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-indazole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G339-0852
1-[(3-methoxyphenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-indazole-6-carboxamide

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

G339-0852

Molecular Formula

C24H23N3O2S (C24 H23 N3 O2 S)

Compound Name

1-[(3-methoxyphenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-indazole-6-carboxamide

IUPAC name

1-[(3-methoxyphenyl)methyl]-N-{[4-(methylsulfanyl)phenyl]methyl}-1H-indazole-6-carboxamide

SMILES

COc1cccc(Cn2ncc(cc3)c2cc3C(NCc(cc2)ccc2SC)=O)c1

InChI

InChI=1S/C24H23N3O2S/c1-29-21-5-3-4-18(12-21)16-27-23-13-19(8-9-20(23)15-26-27)24(28)25-14-17-6-10-22(30-2)11-7-17/h3-13,15H,14,16H2,1-2H3,(H,25,28)

InChI Key

MKQSUROLKKXKQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27136019

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.618

Distribution Coefficient, logD

4.618

Water Solubility, LogSw

-4.53

Polar Surface Area

45.627

Acid Dissociation Constant (pKa)

12.64

Base Dissociation Constant (pKb)

-2.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

G339-0852 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G339-0852 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G339-0852?
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What is the minimum amount of G339-0852 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G339-0852
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G339-0852
  • 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 G339-0852 available by request