8004-6809 Screening compound: 4-(allyloxy)-N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]benzohydrazide

8004-6809 Screening compound: 4-(allyloxy)-N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]benzohydrazide
8004-6809 Screening compound: 4-(allyloxy)-N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-6809
4-(allyloxy)-N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]benzohydrazide

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

8004-6809

Molecular Formula

C15H13BrN2O2S (C15 H13 BrN2 O2 S)

Compound Name

4-(allyloxy)-N'~1~-[(E)-1-(5-bromo-2-thienyl)methylidene]benzohydrazide

IUPAC name

N'-[(E)-(5-bromothiophen-2-yl)methylidene]-4-(prop-2-en-1-yloxy)benzohydrazide

SMILES

C=CCOc(cc1)ccc1C(N/N=C/c(s1)ccc1Br)=O

InChI

InChI=1S/C15H13BrN2O2S/c1-2-9-20-12-5-3-11(4-6-12)15(19)18-17-10-13-7-8-14(16)21-13/h2-8,10H,1,9H2,(H,18,19)

InChI Key

LITOFOYHGVQEPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00558201

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.394

Distribution Coefficient, logD

4.391

Water Solubility, LogSw

-4.38

Polar Surface Area

43.990

Acid Dissociation Constant (pKa)

9.56

Base Dissociation Constant (pKb)

-1.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.67

References: we are preparing a list of scientific research reports with 8004-6809 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-6809?
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What is the minimum amount of 8004-6809 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-6809
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-6809
  • 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 8004-6809 available by request