G802-0873 Screening compound: 7-(5-chloro-2-methylphenyl)-3-[(2-oxo-2-phenylethyl)sulfanyl]-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-8-one

G802-0873 Screening compound: 7-(5-chloro-2-methylphenyl)-3-[(2-oxo-2-phenylethyl)sulfanyl]-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-8-one
G802-0873 Screening compound: 7-(5-chloro-2-methylphenyl)-3-[(2-oxo-2-phenylethyl)sulfanyl]-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-8-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G802-0873
7-(5-chloro-2-methylphenyl)-3-[(2-oxo-2-phenylethyl)sulfanyl]-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-8-one

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

G802-0873

Molecular Formula

C20H15ClN4O2S (C20 H15 ClN4 O2 S)

Compound Name

7-(5-chloro-2-methylphenyl)-3-[(2-oxo-2-phenylethyl)sulfanyl]-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-8-one

IUPAC name

7-(5-chloro-2-methylphenyl)-3-[(2-oxo-2-phenylethyl)sulfanyl]-7H8H-[124]triazolo[43-a]pyrazin-8-one

SMILES

Cc(ccc(Cl)c1)c1N(C=Cn1c(SCC(c2ccccc2)=O)nnc11)C1=O

InChI

InChI=1S/C20H15ClN4O2S/c1-13-7-8-15(21)11-16(13)24-9-10-25-18(19(24)27)22-23-20(25)28-12-17(26)14-5-3-2-4-6-14/h2-11H,12H2,1H3

InChI Key

VTLYAUSWPKIZAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27161724

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.928

Distribution Coefficient, logD

2.928

Water Solubility, LogSw

-3.46

Polar Surface Area

51.648

Acid Dissociation Constant (pKa)

17.29

Base Dissociation Constant (pKb)

-9.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with G802-0873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G802-0873?
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What is the minimum amount of G802-0873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G802-0873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G802-0873
  • 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 G802-0873 available by request