8003-5481 Screening compound: 4-nitro-N'-[(E)-[5-(3-nitrophenyl)furan-2-yl]methylidene]benzohydrazide

8003-5481 Screening compound: 4-nitro-N'-[(E)-[5-(3-nitrophenyl)furan-2-yl]methylidene]benzohydrazide
8003-5481 Screening compound: 4-nitro-N'-[(E)-[5-(3-nitrophenyl)furan-2-yl]methylidene]benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-5481
4-nitro-N'-[(E)-[5-(3-nitrophenyl)furan-2-yl]methylidene]benzohydrazide

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

8003-5481

Molecular Formula

C18H12N4O6 (C18 H12 N4 O6)

Compound Name

4-nitro-N'-[(E)-[5-(3-nitrophenyl)furan-2-yl]methylidene]benzohydrazide

IUPAC name

4-nitro-N'-[(E)-[5-(3-nitrophenyl)furan-2-yl]methylidene]benzohydrazide

SMILES

[O-][N+](c(cc1)ccc1C(N/N=C/c1ccc(-c2cccc([N+]([O-])=O)c2)o1)=O)=O

InChI

InChI=1S/C18H12N4O6/c23-18(12-4-6-14(7-5-12)21(24)25)20-19-11-16-8-9-17(28-16)13-2-1-3-15(10-13)22(26)27/h1-11H,(H,20,23)

InChI Key

CWHHMRBQVFXHSX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00469007

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.32

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.277

Distribution Coefficient, logD

4.276

Water Solubility, LogSw

-4.60

Polar Surface Area

109.887

Acid Dissociation Constant (pKa)

9.94

Base Dissociation Constant (pKb)

-0.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8003-5481 in Drug Discovery

Included in Screening Libraries

Human Kinases Annotated Library (2415 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 8003-5481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-5481?
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What is the minimum amount of 8003-5481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-5481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-5481
  • 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 8003-5481 available by request