8006-1975 Screening compound: 2,4-dibromo-6-[(E)-{[2-(2-cyanophenoxy)acetamido]imino}methyl]phenyl 2-iodobenzoate

8006-1975 Screening compound: 2,4-dibromo-6-[(E)-{[2-(2-cyanophenoxy)acetamido]imino}methyl]phenyl 2-iodobenzoate
8006-1975 Screening compound: 2,4-dibromo-6-[(E)-{[2-(2-cyanophenoxy)acetamido]imino}methyl]phenyl 2-iodobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-1975
2,4-dibromo-6-[(E)-{[2-(2-cyanophenoxy)acetamido]imino}methyl]phenyl 2-iodobenzoate

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

8006-1975

Molecular Formula

C23H14Br2IN3O4 (C23 H14 Br2 IN3 O4)

Compound Name

2,4-dibromo-6-[(E)-{[2-(2-cyanophenoxy)acetamido]imino}methyl]phenyl 2-iodobenzoate

IUPAC name

24-dibromo-6-[(E)-{[2-(2-cyanophenoxy)acetamido]imino}methyl]phenyl 2-iodobenzoate

SMILES

N#Cc(cccc1)c1OCC(N/N=C/c1cc(Br)cc(Br)c1OC(c(cccc1)c1I)=O)=O

InChI

InChI=1S/C23H14Br2IN3O4/c24-16-9-15(12-28-29-21(30)13-32-20-8-4-1-5-14(20)11-27)22(18(25)10-16)33-23(31)17-6-2-3-7-19(17)26/h1-10,12H,13H2,(H,29,30)

InChI Key

ZBZSSLQIQFJQAL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00823917

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

683.09

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.191

Distribution Coefficient, logD

6.153

Water Solubility, LogSw

-5.98

Polar Surface Area

80.534

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

References: we are preparing a list of scientific research reports with 8006-1975 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-1975?
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What is the minimum amount of 8006-1975 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-1975
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-1975
  • 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 8006-1975 available by request