2391-2402 Screening compound: N'-[(E)-{3-[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]pyridine-4-carbohydrazide

2391-2402 Screening compound: N'-[(E)-{3-[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]pyridine-4-carbohydrazide
2391-2402 Screening compound: N'-[(E)-{3-[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]pyridine-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2391-2402
N'-[(E)-{3-[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]pyridine-4-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

2391-2402

Molecular Formula

C19H17BrN6O4 (C19 H17 BrN6 O4)

Compound Name

N'-[(E)-{3-[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]pyridine-4-carbohydrazide

IUPAC name

N'-[(E)-{3-[(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]pyridine-4-carbohydrazide

SMILES

Cc(n(Cc(cc(/C=N/NC(c1ccncc1)=O)cc1)c1OC)nc1[N+]([O-])=O)c1Br

InChI

InChI=1S/C19H17BrN6O4/c1-12-17(20)18(26(28)29)24-25(12)11-15-9-13(3-4-16(15)30-2)10-22-23-19(27)14-5-7-21-8-6-14/h3-10H,11H2,1-2H3,(H,23,27)

InChI Key

DRQUFWBBLXLIFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01841771

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.29

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.386

Distribution Coefficient, logD

2.377

Water Solubility, LogSw

-2.58

Polar Surface Area

99.632

Acid Dissociation Constant (pKa)

9.10

Base Dissociation Constant (pKb)

3.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

2391-2402 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 2391-2402 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2391-2402?
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What is the minimum amount of 2391-2402 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2391-2402
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2391-2402
  • 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 2391-2402 available by request