8002-3729 Screening compound: 2-(2,6-dibromo-4-methylphenoxy)-N'-[(1E)-1-(4-methylphenyl)ethylidene]acetohydrazide

8002-3729 Screening compound: 2-(2,6-dibromo-4-methylphenoxy)-N'-[(1E)-1-(4-methylphenyl)ethylidene]acetohydrazide
8002-3729 Screening compound: 2-(2,6-dibromo-4-methylphenoxy)-N'-[(1E)-1-(4-methylphenyl)ethylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-3729
2-(2,6-dibromo-4-methylphenoxy)-N'-[(1E)-1-(4-methylphenyl)ethylidene]acetohydrazide

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

8002-3729

Molecular Formula

C18H18Br2N2O2 (C18 H18 Br2 N2 O2)

Compound Name

2-(2,6-dibromo-4-methylphenoxy)-N'-[(1E)-1-(4-methylphenyl)ethylidene]acetohydrazide

IUPAC name

2-(26-dibromo-4-methylphenoxy)-N'-[(1E)-1-(4-methylphenyl)ethylidene]acetohydrazide

SMILES

C/C(/c1ccc(C)cc1)=N\NC(COc(c(Br)cc(C)c1)c1Br)=O

InChI

InChI=1S/C18H18Br2N2O2/c1-11-4-6-14(7-5-11)13(3)21-22-17(23)10-24-18-15(19)8-12(2)9-16(18)20/h4-9H,10H2,1-3H3,(H,22,23)

InChI Key

USMBMVMJQQVKDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00383479

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.16

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.463

Distribution Coefficient, logD

5.462

Water Solubility, LogSw

-5.38

Polar Surface Area

42.301

Acid Dissociation Constant (pKa)

10.33

Base Dissociation Constant (pKb)

3.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 8002-3729 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-3729?
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What is the minimum amount of 8002-3729 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-3729
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-3729
  • 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 8002-3729 available by request