C926-0208 Screening compound: 9-(3-chlorophenyl)-2-(3-methylthiophen-2-yl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide

C926-0208 Screening compound: 9-(3-chlorophenyl)-2-(3-methylthiophen-2-yl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
C926-0208 Screening compound: 9-(3-chlorophenyl)-2-(3-methylthiophen-2-yl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C926-0208
9-(3-chlorophenyl)-2-(3-methylthiophen-2-yl)-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

C926-0208

Molecular Formula

C17H12ClN5O2S (C17 H12 ClN5 O2 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1c(-c(nc2N3c4cccc(Cl)c4)nc(C(N)=O)c2NC3=O)scc1

InChI

InChI=1S/C17H12ClN5O2S/c1-8-5-6-26-13(8)15-20-11(14(19)24)12-16(22-15)23(17(25)21-12)10-4-2-3-9(18)7-10/h2-7H,1H3,(H2,19,24)(H,21,25)

InChI Key

HIFWNHWVYCNTHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05715773

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.83

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

3.289

Distribution Coefficient, logD

3.097

Water Solubility, LogSw

-3.58

Polar Surface Area

79.629

Acid Dissociation Constant (pKa)

7.66

Base Dissociation Constant (pKb)

-2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

C926-0208 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C926-0208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C926-0208?
Check Price and Availability of C926-0208, 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 C926-0208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C926-0208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C926-0208
  • 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 C926-0208 available by request