0896-8768 Screening compound: N'1,N'4-bis[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]butanedihydrazide

0896-8768 Screening compound: N'1,N'4-bis[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]butanedihydrazide
0896-8768 Screening compound: N'1,N'4-bis[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]butanedihydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0896-8768
N'1,N'4-bis[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]butanedihydrazide

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

0896-8768

Molecular Formula

C20H22N4O6 (C20 H22 N4 O6)

Compound Name

N'1,N'4-bis[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]butanedihydrazide

IUPAC name

N'1N'4-bis[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]butanedihydrazide

SMILES

COc(cc(/C=N/NC(CCC(N/N=C/c(cc1)cc(OC)c1O)=O)=O)cc1)c1O

InChI

InChI=1S/C20H22N4O6/c1-29-17-9-13(3-5-15(17)25)11-21-23-19(27)7-8-20(28)24-22-12-14-4-6-16(26)18(10-14)30-2/h3-6,9-12,25-26H,7-8H2,1-2H3,(H,23,27)(H,24,28)

InChI Key

VXTMJNISTUIRIM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01536140

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.812

Distribution Coefficient, logD

0.809

Water Solubility, LogSw

-1.94

Polar Surface Area

119.072

Acid Dissociation Constant (pKa)

9.56

Base Dissociation Constant (pKb)

1.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

0896-8768 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Frequent Hitters Library (7624 compounds)

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Structure:
  • Pool
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 0896-8768 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0896-8768?
Check Price and Availability of 0896-8768, 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 0896-8768 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0896-8768
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0896-8768
  • 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 0896-8768 available by request