8002-9791 Screening compound: N-dodecyl-4-octanamidobenzamide

8002-9791 Screening compound: N-dodecyl-4-octanamidobenzamide
8002-9791 Screening compound: N-dodecyl-4-octanamidobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-9791
N-dodecyl-4-octanamidobenzamide

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

8002-9791

Molecular Formula

C27H46N2O2 (C27 H46 N2 O2)

Compound Name

N-dodecyl-4-octanamidobenzamide

IUPAC name

N-dodecyl-4-octanamidobenzamide

SMILES

CCCCCCCCCCCCNC(c(cc1)ccc1NC(CCCCCCC)=O)=O

InChI

InChI=1S/C27H46N2O2/c1-3-5-7-9-10-11-12-13-15-17-23-28-27(31)24-19-21-25(22-20-24)29-26(30)18-16-14-8-6-4-2/h19-22H,3-18,23H2,1-2H3,(H,28,31)(H,29,30)

InChI Key

NMGSQLUURHDKBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00333255

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.67

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

21.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.466

Distribution Coefficient, logD

8.465

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

70.40

8002-9791 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 8002-9791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-9791?
Check Price and Availability of 8002-9791, 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 8002-9791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-9791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-9791
  • 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 8002-9791 available by request