8005-6465 Screening compound: 4-{[(E)-2-(2-bromobenzoyl)hydrazono]methyl}-2-[(4-bromobenzoyl)oxy]phenyl 4-bromobenzoate

8005-6465 Screening compound: 4-{[(E)-2-(2-bromobenzoyl)hydrazono]methyl}-2-[(4-bromobenzoyl)oxy]phenyl 4-bromobenzoate
8005-6465 Screening compound: 4-{[(E)-2-(2-bromobenzoyl)hydrazono]methyl}-2-[(4-bromobenzoyl)oxy]phenyl 4-bromobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-6465
4-{[(E)-2-(2-bromobenzoyl)hydrazono]methyl}-2-[(4-bromobenzoyl)oxy]phenyl 4-bromobenzoate

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

8005-6465

Molecular Formula

C28H17Br3N2O5 (C28 H17 Br3 N2 O5)

Compound Name

4-{[(E)-2-(2-bromobenzoyl)hydrazono]methyl}-2-[(4-bromobenzoyl)oxy]phenyl 4-bromobenzoate

IUPAC name

2-(4-bromobenzoyloxy)-4-[(E)-{[(2-bromophenyl)formamido]imino}methyl]phenyl 4-bromobenzoate

SMILES

O=C(c(cccc1)c1Br)N/N=C/c(cc1)cc(OC(c(cc2)ccc2Br)=O)c1OC(c(cc1)ccc1Br)=O

InChI

InChI=1S/C28H17Br3N2O5/c29-20-10-6-18(7-11-20)27(35)37-24-14-5-17(16-32-33-26(34)22-3-1-2-4-23(22)31)15-25(24)38-28(36)19-8-12-21(30)13-9-19/h1-16H,(H,33,34)

InChI Key

MMSFSPUAPILMLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00821162

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

701.17

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

7.636

Distribution Coefficient, logD

7.600

Water Solubility, LogSw

-6.25

Polar Surface Area

76.483

Acid Dissociation Constant (pKa)

8.47

Base Dissociation Constant (pKb)

-1.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 8005-6465 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-6465?
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What is the minimum amount of 8005-6465 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-6465
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-6465
  • 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 8005-6465 available by request