G856-8043 Screening compound: N-(3,5-dichlorophenyl)-2-({6-[(4-methoxyphenyl)methyl]-7-oxo-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl}sulfanyl)acetamide

G856-8043 Screening compound: N-(3,5-dichlorophenyl)-2-({6-[(4-methoxyphenyl)methyl]-7-oxo-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl}sulfanyl)acetamide
G856-8043 Screening compound: N-(3,5-dichlorophenyl)-2-({6-[(4-methoxyphenyl)methyl]-7-oxo-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G856-8043
N-(3,5-dichlorophenyl)-2-({6-[(4-methoxyphenyl)methyl]-7-oxo-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl}sulfanyl)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

G856-8043

Molecular Formula

C20H16Cl2N6O3S (C20 H16 Cl2 N6 O3 S)

Compound Name

N-(3,5-dichlorophenyl)-2-({6-[(4-methoxyphenyl)methyl]-7-oxo-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl}sulfanyl)acetamide

IUPAC name

N-(35-dichlorophenyl)-2-({6-[(4-methoxyphenyl)methyl]-7-oxo-7H8H-[124]triazolo[43-b][124]triazin-3-yl}sulfanyl)acetamide

SMILES

COc1ccc(CC2=Nn3c(SCC(Nc4cc(Cl)cc(Cl)c4)=O)nnc3NC2=O)cc1

InChI

InChI=1S/C20H16Cl2N6O3S/c1-31-15-4-2-11(3-5-15)6-16-18(30)24-19-25-26-20(28(19)27-16)32-10-17(29)23-14-8-12(21)7-13(22)9-14/h2-5,7-9H,6,10H2,1H3,(H,23,29)(H,24,25,30)

InChI Key

VJIVWWSZSBAHCD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06749331

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.36

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.216

Distribution Coefficient, logD

4.206

Water Solubility, LogSw

-4.58

Polar Surface Area

91.626

Acid Dissociation Constant (pKa)

9.04

Base Dissociation Constant (pKb)

-0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

G856-8043 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G856-8043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-8043?
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What is the minimum amount of G856-8043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-8043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-8043
  • 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 G856-8043 available by request