G656-0613 Screening compound: 2-(2,4-difluorophenyl)-9-(4-ethoxyphenyl)-7-ethyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

G656-0613 Screening compound: 2-(2,4-difluorophenyl)-9-(4-ethoxyphenyl)-7-ethyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
G656-0613 Screening compound: 2-(2,4-difluorophenyl)-9-(4-ethoxyphenyl)-7-ethyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G656-0613
2-(2,4-difluorophenyl)-9-(4-ethoxyphenyl)-7-ethyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

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

G656-0613

Molecular Formula

C22H19F2N5O3 (C22 H19 F2 N5 O3)

Compound Name

2-(2,4-difluorophenyl)-9-(4-ethoxyphenyl)-7-ethyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

IUPAC name

2-(24-difluorophenyl)-9-(4-ethoxyphenyl)-7-ethyl-8-oxo-89-dihydro-7H-purine-6-carboxamide

SMILES

CCN(c1c(C(N)=O)nc(-c(ccc(F)c2)c2F)nc1N1c(cc2)ccc2OCC)C1=O

InChI

InChI=1S/C22H19F2N5O3/c1-3-28-18-17(19(25)30)26-20(15-10-5-12(23)11-16(15)24)27-21(18)29(22(28)31)13-6-8-14(9-7-13)32-4-2/h5-11H,3-4H2,1-2H3,(H2,25,30)

InChI Key

NVFYJJUPEOAJQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27149785

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.678

Distribution Coefficient, logD

3.678

Water Solubility, LogSw

-4.07

Polar Surface Area

79.926

Acid Dissociation Constant (pKa)

13.04

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

G656-0613 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Antimitotic Tubulin Library (17355 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G656-0613 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G656-0613?
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What is the minimum amount of G656-0613 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G656-0613
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G656-0613
  • 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 G656-0613 available by request