8002-7467 Screening compound: 3-[(E)-({2-[(3-fluorophenyl)formamido]acetamido}imino)methyl]phenyl furan-2-carboxylate

8002-7467 Screening compound: 3-[(E)-({2-[(3-fluorophenyl)formamido]acetamido}imino)methyl]phenyl furan-2-carboxylate
8002-7467 Screening compound: 3-[(E)-({2-[(3-fluorophenyl)formamido]acetamido}imino)methyl]phenyl furan-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-7467
3-[(E)-({2-[(3-fluorophenyl)formamido]acetamido}imino)methyl]phenyl furan-2-carboxylate

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

8002-7467

Molecular Formula

C21H16FN3O5 (C21 H16 FN3 O5)

Compound Name

3-[(E)-({2-[(3-fluorophenyl)formamido]acetamido}imino)methyl]phenyl furan-2-carboxylate

IUPAC name

3-[(E)-({2-[(3-fluorophenyl)formamido]acetamido}imino)methyl]phenyl furan-2-carboxylate

SMILES

O=C(CNC(c1cccc(F)c1)=O)N/N=C/c1cc(OC(c2ccco2)=O)ccc1

InChI

InChI=1S/C21H16FN3O5/c22-16-6-2-5-15(11-16)20(27)23-13-19(26)25-24-12-14-4-1-7-17(10-14)30-21(28)18-8-3-9-29-18/h1-12H,13H2,(H,23,27)(H,25,26)

InChI Key

NBUJDLOBIZNEDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00733436

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.826

Distribution Coefficient, logD

2.826

Water Solubility, LogSw

-3.38

Polar Surface Area

88.982

Acid Dissociation Constant (pKa)

11.25

Base Dissociation Constant (pKb)

-2.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

References: we are preparing a list of scientific research reports with 8002-7467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-7467?
Check Price and Availability of 8002-7467, 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 8002-7467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-7467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-7467
  • 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 8002-7467 available by request