8005-4096 Screening compound: 4-decanamido-N-octadecylbenzamide

8005-4096 Screening compound: 4-decanamido-N-octadecylbenzamide
8005-4096 Screening compound: 4-decanamido-N-octadecylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-4096
4-decanamido-N-octadecylbenzamide

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

8005-4096

Molecular Formula

C35H62N2O2 (C35 H62 N2 O2)

Compound Name

4-decanamido-N-octadecylbenzamide

IUPAC name

4-decanamido-N-octadecylbenzamide

SMILES

CCCCCCCCCCCCCCCCCCNC(c(cc1)ccc1NC(CCCCCCCCC)=O)=O

InChI

InChI=1S/C35H62N2O2/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-31-36-35(39)32-27-29-33(30-28-32)37-34(38)26-24-22-20-10-8-6-4-2/h27-30H,3-26,31H2,1-2H3,(H,36,39)(H,37,38)

InChI Key

MASBQCRWAQGYMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00313907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

542.89

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

29.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

12.433

Distribution Coefficient, logD

12.432

Water Solubility, LogSw

-5.80

Polar Surface Area

47.914

Acid Dissociation Constant (pKa)

10.33

Base Dissociation Constant (pKb)

-0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

77.10

8005-4096 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Lipid Metabolism Library (9174 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Metabolic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8005-4096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-4096?
Check Price and Availability of 8005-4096, 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 8005-4096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-4096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-4096
  • 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 8005-4096 available by request