1306-0049 Screening compound: 1-methyl-N'-[(E)-(2-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide

1306-0049 Screening compound: 1-methyl-N'-[(E)-(2-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide
1306-0049 Screening compound: 1-methyl-N'-[(E)-(2-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1306-0049
1-methyl-N'-[(E)-(2-nitrophenyl)methylidene]-1H-pyrazole-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

1306-0049

Molecular Formula

C12H11N5O3 (C12 H11 N5 O3)

Compound Name

1-methyl-N'-[(E)-(2-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide

IUPAC name

1-methyl-N'-[(E)-(2-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide

SMILES

Cn(cc1)nc1C(N/N=C/c(cccc1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C12H11N5O3/c1-16-7-6-10(15-16)12(18)14-13-8-9-4-2-3-5-11(9)17(19)20/h2-8H,1H3,(H,14,18)

InChI Key

JXWAMOGWHDEMDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00427044

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

273.25

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.354

Distribution Coefficient, logD

1.336

Water Solubility, LogSw

-2.05

Polar Surface Area

83.327

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

0.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

1306-0049 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

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 1306-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1306-0049?
Check Price and Availability of 1306-0049, 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 1306-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1306-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1306-0049
  • 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 1306-0049 available by request