G653-0002 Screening compound: 7-(3-fluorophenyl)-2-[2-(4-fluorophenyl)-2-oxoethyl][1,2,4]triazolo[4,3-a]pyrazine-3,8(2H,7H)-dione

G653-0002 Screening compound: 7-(3-fluorophenyl)-2-[2-(4-fluorophenyl)-2-oxoethyl][1,2,4]triazolo[4,3-a]pyrazine-3,8(2H,7H)-dione
G653-0002 Screening compound: 7-(3-fluorophenyl)-2-[2-(4-fluorophenyl)-2-oxoethyl][1,2,4]triazolo[4,3-a]pyrazine-3,8(2H,7H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound G653-0002
7-(3-fluorophenyl)-2-[2-(4-fluorophenyl)-2-oxoethyl][1,2,4]triazolo[4,3-a]pyrazine-3,8(2H,7H)-dione

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

G653-0002

Molecular Formula

C19H12F2N4O3 (C19 H12 F2 N4 O3)

Compound Name

7-(3-fluorophenyl)-2-[2-(4-fluorophenyl)-2-oxoethyl][1,2,4]triazolo[4,3-a]pyrazine-3,8(2H,7H)-dione

IUPAC name

n/a

SMILES

O=C(CN1N=C(C(N(C=C2)c3cccc(F)c3)=O)N2C1=O)c(cc1)ccc1F

InChI

InChI=1S/C19H12F2N4O3/c20-13-6-4-12(5-7-13)16(26)11-25-19(28)24-9-8-23(18(27)17(24)22-25)15-3-1-2-14(21)10-15/h1-10H,11H2

InChI Key

RJJHOEKIVMGODM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15026159

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.509

Distribution Coefficient, logD

1.509

Water Solubility, LogSw

-1.99

Polar Surface Area

59.625

Acid Dissociation Constant (pKa)

15.83

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

G653-0002 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G653-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G653-0002?
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What is the minimum amount of G653-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G653-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G653-0002
  • 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 G653-0002 available by request