8005-5708 Screening compound: N'~1~-[(E)-1-(4-cyanophenyl)methylidene]-4-methylbenzohydrazide

8005-5708 Screening compound: N'~1~-[(E)-1-(4-cyanophenyl)methylidene]-4-methylbenzohydrazide
8005-5708 Screening compound: N'~1~-[(E)-1-(4-cyanophenyl)methylidene]-4-methylbenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-5708
N'~1~-[(E)-1-(4-cyanophenyl)methylidene]-4-methylbenzohydrazide

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

8005-5708

Molecular Formula

C16H13N3O (C16 H13 N3 O)

Compound Name

N'~1~-[(E)-1-(4-cyanophenyl)methylidene]-4-methylbenzohydrazide

IUPAC name

N'-[(E)-(4-cyanophenyl)methylidene]-4-methylbenzohydrazide

SMILES

Cc(cc1)ccc1C(N/N=C/c(cc1)ccc1C#N)=O

InChI

InChI=1S/C16H13N3O/c1-12-2-8-15(9-3-12)16(20)19-18-11-14-6-4-13(10-17)5-7-14/h2-9,11H,1H3,(H,19,20)

InChI Key

VXZVJIZMKHRMAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00820525

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

263.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.042

Distribution Coefficient, logD

3.032

Water Solubility, LogSw

-3.21

Polar Surface Area

52.610

Acid Dissociation Constant (pKa)

9.01

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.25

8005-5708 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8005-5708 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-5708?
Check Price and Availability of 8005-5708, 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 8005-5708 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-5708
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-5708
  • 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 8005-5708 available by request