G656-0764 Screening compound: 7-benzyl-2-(4-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

G656-0764 Screening compound: 7-benzyl-2-(4-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
G656-0764 Screening compound: 7-benzyl-2-(4-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G656-0764
7-benzyl-2-(4-chlorophenyl)-9-(4-fluorophenyl)-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

G656-0764

Molecular Formula

C25H17ClFN5O2 (C25 H17 ClFN5 O2)

Compound Name

7-benzyl-2-(4-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

IUPAC name

7-benzyl-2-(4-chlorophenyl)-9-(4-fluorophenyl)-8-oxo-89-dihydro-7H-purine-6-carboxamide

SMILES

NC(c(nc(-c(cc1)ccc1Cl)nc1N2c(cc3)ccc3F)c1N(Cc1ccccc1)C2=O)=O

InChI

InChI=1S/C25H17ClFN5O2/c26-17-8-6-16(7-9-17)23-29-20(22(28)33)21-24(30-23)32(19-12-10-18(27)11-13-19)25(34)31(21)14-15-4-2-1-3-5-15/h1-13H,14H2,(H2,28,33)

InChI Key

PCXQNZYSRAQZIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27149811

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.89

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.782

Distribution Coefficient, logD

5.782

Water Solubility, LogSw

-6.05

Polar Surface Area

72.806

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

-2.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

G656-0764 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G656-0764 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G656-0764?
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What is the minimum amount of G656-0764 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G656-0764
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G656-0764
  • 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 G656-0764 available by request