8002-9315 Screening compound: N'-[(1E)-hexadecylidene]-3,5-dinitrobenzohydrazide

8002-9315 Screening compound: N'-[(1E)-hexadecylidene]-3,5-dinitrobenzohydrazide
8002-9315 Screening compound: N'-[(1E)-hexadecylidene]-3,5-dinitrobenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-9315
N'-[(1E)-hexadecylidene]-3,5-dinitrobenzohydrazide

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

8002-9315

Molecular Formula

C23H36N4O5 (C23 H36 N4 O5)

Compound Name

N'-[(1E)-hexadecylidene]-3,5-dinitrobenzohydrazide

IUPAC name

N'-[(1E)-hexadecylidene]-35-dinitrobenzohydrazide

SMILES

CCCCCCCCCCCCCCC/C=N/NC(c1cc([N+]([O-])=O)cc([N+]([O-])=O)c1)=O

InChI

InChI=1S/C23H36N4O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24-25-23(28)20-17-21(26(29)30)19-22(18-20)27(31)32/h16-19H,2-15H2,1H3,(H,25,28)

InChI Key

STMHTFVAOGGVJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00333095

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.56

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

19.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

8.632

Distribution Coefficient, logD

8.100

Water Solubility, LogSw

-5.74

Polar Surface Area

103.220

Acid Dissociation Constant (pKa)

7.02

Base Dissociation Constant (pKb)

0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.20

8002-9315 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8002-9315 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-9315?
Check Price and Availability of 8002-9315, 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 8002-9315 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-9315
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-9315
  • 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 8002-9315 available by request