8003-5059 Screening compound: 1-{N'-[(E)-{4-[(4-nitrophenyl)methoxy]phenyl}methylidene]hydrazinecarbonyl}-N-(pyridin-2-yl)formamide

8003-5059 Screening compound: 1-{N'-[(E)-{4-[(4-nitrophenyl)methoxy]phenyl}methylidene]hydrazinecarbonyl}-N-(pyridin-2-yl)formamide
8003-5059 Screening compound: 1-{N'-[(E)-{4-[(4-nitrophenyl)methoxy]phenyl}methylidene]hydrazinecarbonyl}-N-(pyridin-2-yl)formamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-5059
1-{N'-[(E)-{4-[(4-nitrophenyl)methoxy]phenyl}methylidene]hydrazinecarbonyl}-N-(pyridin-2-yl)formamide

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

8003-5059

Molecular Formula

C21H17N5O5 (C21 H17 N5 O5)

Compound Name

1-{N'-[(E)-{4-[(4-nitrophenyl)methoxy]phenyl}methylidene]hydrazinecarbonyl}-N-(pyridin-2-yl)formamide

IUPAC name

1-{N'-[(E)-{4-[(4-nitrophenyl)methoxy]phenyl}methylidene]hydrazinecarbonyl}-N-(pyridin-2-yl)formamide

SMILES

[O-][N+](c1ccc(COc2ccc(/C=N/NC(C(Nc3ncccc3)=O)=O)cc2)cc1)=O

InChI

InChI=1S/C21H17N5O5/c27-20(24-19-3-1-2-12-22-19)21(28)25-23-13-15-6-10-18(11-7-15)31-14-16-4-8-17(9-5-16)26(29)30/h1-13H,14H2,(H,25,28)(H,22,24,27)

InChI Key

DICIGATXUXLESD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00735291

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.4

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.273

Distribution Coefficient, logD

1.118

Water Solubility, LogSw

-3.49

Polar Surface Area

109.141

Acid Dissociation Constant (pKa)

5.25

Base Dissociation Constant (pKb)

3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

8003-5059 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8003-5059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-5059?
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What is the minimum amount of 8003-5059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-5059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-5059
  • 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 8003-5059 available by request