1465-0022 Screening compound: 2-methylphenyl [2-(9H-purin-6-ylsulfanyl)ethyl] ether

1465-0022 Screening compound: 2-methylphenyl [2-(9H-purin-6-ylsulfanyl)ethyl] ether
1465-0022 Screening compound: 2-methylphenyl [2-(9H-purin-6-ylsulfanyl)ethyl] ether alternative view

Chemical Structure Depiction of ChemDiv screening compound 1465-0022
2-methylphenyl [2-(9H-purin-6-ylsulfanyl)ethyl] ether

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

1465-0022

Molecular Formula

C14H14N4OS (C14 H14 N4 OS)

Compound Name

2-methylphenyl [2-(9H-purin-6-ylsulfanyl)ethyl] ether

IUPAC name

6-{[2-(2-methylphenoxy)ethyl]sulfanyl}-9H-purine

SMILES

Cc(cccc1)c1OCCSc1ncnc2c1nc[nH]2

InChI

InChI=1S/C14H14N4OS/c1-10-4-2-3-5-11(10)19-6-7-20-14-12-13(16-8-15-12)17-9-18-14/h2-5,8-9H,6-7H2,1H3,(H,15,16,17,18)

InChI Key

LAOLFSUJAHLPQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01078386

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.364

Distribution Coefficient, logD

2.364

Water Solubility, LogSw

-2.44

Polar Surface Area

50.039

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

2.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.43

1465-0022 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Nucleoside Mimetics Library (2197 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Purine Based Nucleoside Mimetics Library (1131 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Cancer
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Structure:
  • Mimetics
Targets:
  • Others

References: we are preparing a list of scientific research reports with 1465-0022 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1465-0022?
Check Price and Availability of 1465-0022, 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 1465-0022 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1465-0022
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1465-0022
  • 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 1465-0022 available by request