G856-7979 Screening compound: N-(3-chlorophenyl)-2-{[6-(4-methoxyphenyl)-7-oxo-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl}acetamide

G856-7979 Screening compound: N-(3-chlorophenyl)-2-{[6-(4-methoxyphenyl)-7-oxo-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl}acetamide
G856-7979 Screening compound: N-(3-chlorophenyl)-2-{[6-(4-methoxyphenyl)-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 G856-7979
N-(3-chlorophenyl)-2-{[6-(4-methoxyphenyl)-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

G856-7979

Molecular Formula

C19H15ClN6O3S (C19 H15 ClN6 O3 S)

Compound Name

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

IUPAC name

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

SMILES

COc(cc1)ccc1C1=Nn2c(SCC(Nc3cccc(Cl)c3)=O)nnc2NC1=O

InChI

InChI=1S/C19H15ClN6O3S/c1-29-14-7-5-11(6-8-14)16-17(28)22-18-23-24-19(26(18)25-16)30-10-15(27)21-13-4-2-3-12(20)9-13/h2-9H,10H2,1H3,(H,21,27)(H,22,23,28)

InChI Key

DDWABFOBVPREFE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06749286

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.89

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.292

Distribution Coefficient, logD

3.290

Water Solubility, LogSw

-3.82

Polar Surface Area

91.722

Acid Dissociation Constant (pKa)

9.73

Base Dissociation Constant (pKb)

0.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

G856-7979 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 G856-7979 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G856-7979?
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What is the minimum amount of G856-7979 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G856-7979
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G856-7979
  • 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 G856-7979 available by request