8006-6493 Screening compound: N-(2-methylphenyl)-N-{2-[N-(2-methylphenyl)dodecanamido]ethyl}dodecanamide

8006-6493 Screening compound: N-(2-methylphenyl)-N-{2-[N-(2-methylphenyl)dodecanamido]ethyl}dodecanamide
8006-6493 Screening compound: N-(2-methylphenyl)-N-{2-[N-(2-methylphenyl)dodecanamido]ethyl}dodecanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-6493
N-(2-methylphenyl)-N-{2-[N-(2-methylphenyl)dodecanamido]ethyl}dodecanamide

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

8006-6493

Molecular Formula

C40H64N2O2 (C40 H64 N2 O2)

Compound Name

N-(2-methylphenyl)-N-{2-[N-(2-methylphenyl)dodecanamido]ethyl}dodecanamide

IUPAC name

N-(2-methylphenyl)-N-{2-[N-(2-methylphenyl)dodecanamido]ethyl}dodecanamide

SMILES

CCCCCCCCCCCC(N(CCN(C(CCCCCCCCCCC)=O)c1c(C)cccc1)c1c(C)cccc1)=O

InChI

InChI=1S/C40H64N2O2/c1-5-7-9-11-13-15-17-19-21-31-39(43)41(37-29-25-23-27-35(37)3)33-34-42(38-30-26-24-28-36(38)4)40(44)32-22-20-18-16-14-12-10-8-6-2/h23-30H,5-22,31-34H2,1-4H3

InChI Key

AVVJRONZLIBUNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00626102

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

604.96

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

27.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

13.722

Distribution Coefficient, logD

13.722

Water Solubility, LogSw

-5.69

Polar Surface Area

30.055

Acid Dissociation Constant (pKa)

22.89

Base Dissociation Constant (pKb)

-0.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

8006-6493 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 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
  • 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 8006-6493 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-6493?
Check Price and Availability of 8006-6493, 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 8006-6493 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-6493
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-6493
  • 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 8006-6493 available by request