4596-0207 Screening compound: N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-4-methyl-1,2,5-oxadiazole-3-carbohydrazide

4596-0207 Screening compound: N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-4-methyl-1,2,5-oxadiazole-3-carbohydrazide
4596-0207 Screening compound: N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-4-methyl-1,2,5-oxadiazole-3-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4596-0207
N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-4-methyl-1,2,5-oxadiazole-3-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

4596-0207

Molecular Formula

C12H12N4O4 (C12 H12 N4 O4)

Compound Name

N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-4-methyl-1,2,5-oxadiazole-3-carbohydrazide

IUPAC name

N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-4-methyl-125-oxadiazole-3-carbohydrazide

SMILES

Cc1nonc1C(N/N=C/c(cc1)cc(OC)c1O)=O

InChI

InChI=1S/C12H12N4O4/c1-7-11(16-20-15-7)12(18)14-13-6-8-3-4-9(17)10(5-8)19-2/h3-6,17H,1-2H3,(H,14,18)

InChI Key

TXCPHLKQHIHYTK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00713794

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.25

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.559

Distribution Coefficient, logD

1.548

Water Solubility, LogSw

-2.00

Polar Surface Area

96.698

Acid Dissociation Constant (pKa)

8.97

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

4596-0207 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4596-0207 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4596-0207?
Check Price and Availability of 4596-0207, 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 4596-0207 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4596-0207
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4596-0207
  • 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 4596-0207 available by request