8009-8667 Screening compound: 5-(benzyloxy)-3,8,9-trioxatricyclo[4.2.1.0~2,4~]nonane

8009-8667 Screening compound: 5-(benzyloxy)-3,8,9-trioxatricyclo[4.2.1.0~2,4~]nonane
8009-8667 Screening compound: 5-(benzyloxy)-3,8,9-trioxatricyclo[4.2.1.0~2,4~]nonane alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-8667
5-(benzyloxy)-3,8,9-trioxatricyclo[4.2.1.0~2,4~]nonane

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

8009-8667

Molecular Formula

C13H14O4 (C13 H14 O4)

Compound Name

5-(benzyloxy)-3,8,9-trioxatricyclo[4.2.1.0~2,4~]nonane

IUPAC name

5-(benzyloxy)-389-trioxatricyclo[4.2.1.0^{24}]nonane

SMILES

C(c1ccccc1)OC(C1OC11)C2OC1OC2

InChI

InChI=1S/C13H14O4/c1-2-4-8(5-3-1)6-14-10-9-7-15-13(16-9)12-11(10)17-12/h1-5,9-13H,6-7H2

InChI Key

YVZYNXNBLFZJNU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01820798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

234.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.470

Distribution Coefficient, logD

1.470

Water Solubility, LogSw

-0.99

Polar Surface Area

33.931

Acid Dissociation Constant (pKa)

25.10

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

5.00

Percent sp3 carbon bonding

53.80

8009-8667 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8009-8667 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-8667?
Check Price and Availability of 8009-8667, 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 8009-8667 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-8667
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-8667
  • 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 8009-8667 available by request