8006-2008 Screening compound: 2-methoxy-4-[(E)-{[2-(naphthalen-1-yl)acetamido]imino}methyl]phenyl 3-fluorobenzoate

8006-2008 Screening compound: 2-methoxy-4-[(E)-{[2-(naphthalen-1-yl)acetamido]imino}methyl]phenyl 3-fluorobenzoate
8006-2008 Screening compound: 2-methoxy-4-[(E)-{[2-(naphthalen-1-yl)acetamido]imino}methyl]phenyl 3-fluorobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-2008
2-methoxy-4-[(E)-{[2-(naphthalen-1-yl)acetamido]imino}methyl]phenyl 3-fluorobenzoate

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

8006-2008

Molecular Formula

C27H21FN2O4 (C27 H21 FN2 O4)

Compound Name

2-methoxy-4-[(E)-{[2-(naphthalen-1-yl)acetamido]imino}methyl]phenyl 3-fluorobenzoate

IUPAC name

2-methoxy-4-[(E)-{[2-(naphthalen-1-yl)acetamido]imino}methyl]phenyl 3-fluorobenzoate

SMILES

COc(cc(/C=N/NC(Cc1cccc2ccccc12)=O)cc1)c1OC(c1cccc(F)c1)=O

InChI

InChI=1S/C27H21FN2O4/c1-33-25-14-18(12-13-24(25)34-27(32)21-9-5-10-22(28)15-21)17-29-30-26(31)16-20-8-4-7-19-6-2-3-11-23(19)20/h2-15,17H,16H2,1H3,(H,30,31)

InChI Key

TUEMDQMHSQDTBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00823945

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.309

Distribution Coefficient, logD

5.308

Water Solubility, LogSw

-6.48

Polar Surface Area

63.164

Acid Dissociation Constant (pKa)

10.29

Base Dissociation Constant (pKb)

2.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.40

8006-2008 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8006-2008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-2008?
Check Price and Availability of 8006-2008, 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 8006-2008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-2008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-2008
  • 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 8006-2008 available by request