1306-0084 Screening compound: 4-iodo-1-methyl-N'-[(E)-(3-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide

1306-0084 Screening compound: 4-iodo-1-methyl-N'-[(E)-(3-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide
1306-0084 Screening compound: 4-iodo-1-methyl-N'-[(E)-(3-nitrophenyl)methylidene]-1H-pyrazole-3-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1306-0084
4-iodo-1-methyl-N'-[(E)-(3-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

1306-0084

Molecular Formula

C12H10IN5O3 (C12 H10 IN5 O3)

Compound Name

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

IUPAC name

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

SMILES

Cn1nc(C(N/N=C/c2cc([N+]([O-])=O)ccc2)=O)c(I)c1

InChI

InChI=1S/C12H10IN5O3/c1-17-7-10(13)11(16-17)12(19)15-14-6-8-3-2-4-9(5-8)18(20)21/h2-7H,1H3,(H,15,19)

InChI Key

FAOUDUGVPJCKQU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00605175

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.15

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

2.083

Distribution Coefficient, logD

2.067

Water Solubility, LogSw

-2.93

Polar Surface Area

84.291

Acid Dissociation Constant (pKa)

8.81

Base Dissociation Constant (pKb)

-0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with 1306-0084 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1306-0084?
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What is the minimum amount of 1306-0084 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1306-0084
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1306-0084
  • 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 1306-0084 available by request