0724-0053 Screening compound: 3-[(2E)-2-{[4-(dimethylamino)phenyl]methylidene}hydrazin-1-yl]benzoic acid

0724-0053 Screening compound: 3-[(2E)-2-{[4-(dimethylamino)phenyl]methylidene}hydrazin-1-yl]benzoic acid
0724-0053 Screening compound: 3-[(2E)-2-{[4-(dimethylamino)phenyl]methylidene}hydrazin-1-yl]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0724-0053
3-[(2E)-2-{[4-(dimethylamino)phenyl]methylidene}hydrazin-1-yl]benzoic acid

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

0724-0053

Molecular Formula

C16H17N3O2 (C16 H17 N3 O2)

Compound Name

3-[(2E)-2-{[4-(dimethylamino)phenyl]methylidene}hydrazin-1-yl]benzoic acid

IUPAC name

3-[(2E)-2-{[4-(dimethylamino)phenyl]methylidene}hydrazin-1-yl]benzoic acid

SMILES

CN(C)c1ccc(/C=N/Nc2cccc(C(O)=O)c2)cc1

InChI

InChI=1S/C16H17N3O2/c1-19(2)15-8-6-12(7-9-15)11-17-18-14-5-3-4-13(10-14)16(20)21/h3-11,18H,1-2H3,(H,20,21)

InChI Key

VJJXVBDYMKJSQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00418646

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.840

Distribution Coefficient, logD

0.758

Water Solubility, LogSw

-3.93

Polar Surface Area

52.588

Acid Dissociation Constant (pKa)

4.01

Base Dissociation Constant (pKb)

3.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

0724-0053 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 0724-0053 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0724-0053?
Check Price and Availability of 0724-0053, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 0724-0053 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0724-0053
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0724-0053
  • 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 0724-0053 available by request