G656-0830 Screening compound: 9-(4-FLUOROPHENYL)-2-[4-(METHYLSULFANYL)PHENYL]-8-OXO-8,9-DIHYDRO-7H-PURINE-6-CARBOXAMIDE

G656-0830 Screening compound: 9-(4-FLUOROPHENYL)-2-[4-(METHYLSULFANYL)PHENYL]-8-OXO-8,9-DIHYDRO-7H-PURINE-6-CARBOXAMIDE
G656-0830 Screening compound: 9-(4-FLUOROPHENYL)-2-[4-(METHYLSULFANYL)PHENYL]-8-OXO-8,9-DIHYDRO-7H-PURINE-6-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G656-0830
9-(4-FLUOROPHENYL)-2-[4-(METHYLSULFANYL)PHENYL]-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

G656-0830

Molecular Formula

C19H14FN5O2S (C19 H14 FN5 O2 S)

Compound Name

9-(4-FLUOROPHENYL)-2-[4-(METHYLSULFANYL)PHENYL]-8-OXO-8,9-DIHYDRO-7H-PURINE-6-CARBOXAMIDE

IUPAC name

n/a

SMILES

CSc(cc1)ccc1-c(nc1N2c(cc3)ccc3F)nc(C(N)=O)c1NC2=O

InChI

InChI=1S/C19H14FN5O2S/c1-28-13-8-2-10(3-9-13)17-22-14(16(21)26)15-18(24-17)25(19(27)23-15)12-6-4-11(20)5-7-12/h2-9H,1H3,(H2,21,26)(H,23,27)

InChI Key

KMCRLAXRUPYEHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15026172

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.695

Distribution Coefficient, logD

3.658

Water Solubility, LogSw

-4.20

Polar Surface Area

78.611

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

G656-0830 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G656-0830 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G656-0830?
Check Price and Availability of G656-0830, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G656-0830 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G656-0830
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G656-0830
  • 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 G656-0830 available by request