C926-0341 Screening compound: 9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide

C926-0341 Screening compound: 9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide
C926-0341 Screening compound: 9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C926-0341
9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-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

C926-0341

Molecular Formula

C17H13N5O2S (C17 H13 N5 O2 S)

Compound Name

9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-8,9-dihydro-7H-purine-6-carboxamide

IUPAC name

9-(3-methylphenyl)-8-oxo-2-(thiophen-2-yl)-89-dihydro-7H-purine-6-carboxamide

SMILES

Cc1cccc(N(c2nc(-c3cccs3)nc(C(N)=O)c2N2)C2=O)c1

InChI

InChI=1S/C17H13N5O2S/c1-9-4-2-5-10(8-9)22-16-13(20-17(22)24)12(14(18)23)19-15(21-16)11-6-3-7-25-11/h2-8H,1H3,(H2,18,23)(H,20,24)

InChI Key

CIBCLNINYWYXEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05893890

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.835

Distribution Coefficient, logD

2.830

Water Solubility, LogSw

-3.18

Polar Surface Area

79.629

Acid Dissociation Constant (pKa)

9.32

Base Dissociation Constant (pKb)

-2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

C926-0341 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 C926-0341 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C926-0341?
Check Price and Availability of C926-0341, 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 C926-0341 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C926-0341
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C926-0341
  • 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 C926-0341 available by request