G802-0294 Screening compound: N-(2,5-difluorophenyl)-2-{[7-(4-methoxyphenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}acetamide

G802-0294 Screening compound: N-(2,5-difluorophenyl)-2-{[7-(4-methoxyphenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}acetamide
G802-0294 Screening compound: N-(2,5-difluorophenyl)-2-{[7-(4-methoxyphenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G802-0294
N-(2,5-difluorophenyl)-2-{[7-(4-methoxyphenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-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

G802-0294

Molecular Formula

C20H15F2N5O3S (C20 H15 F2 N5 O3 S)

Compound Name

N-(2,5-difluorophenyl)-2-{[7-(4-methoxyphenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]sulfanyl}acetamide

IUPAC name

N-(25-difluorophenyl)-2-{[7-(4-methoxyphenyl)-8-oxo-7H8H-[124]triazolo[43-a]pyrazin-3-yl]sulfanyl}acetamide

SMILES

COc(cc1)ccc1N(C=Cn1c(SCC(Nc(cc(cc2)F)c2F)=O)nnc11)C1=O

InChI

InChI=1S/C20H15F2N5O3S/c1-30-14-5-3-13(4-6-14)26-8-9-27-18(19(26)29)24-25-20(27)31-11-17(28)23-16-10-12(21)2-7-15(16)22/h2-10H,11H2,1H3,(H,23,28)

InChI Key

VUOMNZJLTBYZAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27161276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.886

Distribution Coefficient, logD

1.877

Water Solubility, LogSw

-2.75

Polar Surface Area

68.698

Acid Dissociation Constant (pKa)

9.13

Base Dissociation Constant (pKb)

-5.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

G802-0294 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G802-0294 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G802-0294?
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What is the minimum amount of G802-0294 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G802-0294
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G802-0294
  • 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 G802-0294 available by request