5408-1934 Screening compound: 5-bromo-N'-[(Z)-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]-1-benzofuran-2-carbohydrazide

5408-1934 Screening compound: 5-bromo-N'-[(Z)-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]-1-benzofuran-2-carbohydrazide
5408-1934 Screening compound: 5-bromo-N'-[(Z)-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]-1-benzofuran-2-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5408-1934
5-bromo-N'-[(Z)-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]-1-benzofuran-2-carbohydrazide

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

5408-1934

Molecular Formula

C21H19BrN2O4 (C21 H19 BrN2 O4)

Compound Name

5-bromo-N'-[(Z)-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]-1-benzofuran-2-carbohydrazide

IUPAC name

5-bromo-N'-[(Z)-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]-1-benzofuran-2-carbohydrazide

SMILES

CCOc(cc(/C=N\NC(c1cc(cc(cc2)Br)c2o1)=O)cc1)c1OCC=C

InChI

InChI=1S/C21H19BrN2O4/c1-3-9-27-18-7-5-14(10-19(18)26-4-2)13-23-24-21(25)20-12-15-11-16(22)6-8-17(15)28-20/h3,5-8,10-13H,1,4,9H2,2H3,(H,24,25)

InChI Key

DLVKQSKXZCYNOL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03827325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.3

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.137

Distribution Coefficient, logD

5.134

Water Solubility, LogSw

-5.27

Polar Surface Area

58.562

Acid Dissociation Constant (pKa)

9.67

Base Dissociation Constant (pKb)

2.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

5408-1934 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5408-1934 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5408-1934?
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What is the minimum amount of 5408-1934 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5408-1934
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5408-1934
  • 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 5408-1934 available by request