4191-0835 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[(4-methylphenyl)methyl]ethanediamide

4191-0835 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[(4-methylphenyl)methyl]ethanediamide
4191-0835 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[(4-methylphenyl)methyl]ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4191-0835
N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[(4-methylphenyl)methyl]ethanediamide

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

4191-0835

Molecular Formula

C20H24N2O4 (C20 H24 N2 O4)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[(4-methylphenyl)methyl]ethanediamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-N'-[(4-methylphenyl)methyl]ethanediamide

SMILES

Cc1ccc(CNC(C(NCCc(cc2)cc(OC)c2OC)=O)=O)cc1

InChI

InChI=1S/C20H24N2O4/c1-14-4-6-16(7-5-14)13-22-20(24)19(23)21-11-10-15-8-9-17(25-2)18(12-15)26-3/h4-9,12H,10-11,13H2,1-3H3,(H,21,23)(H,22,24)

InChI Key

OTCMKSPNURAPBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01204667

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.810

Distribution Coefficient, logD

1.778

Water Solubility, LogSw

-2.08

Polar Surface Area

64.439

Acid Dissociation Constant (pKa)

8.53

Base Dissociation Constant (pKb)

2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

4191-0835 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Agro:
  • Agro
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 4191-0835 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4191-0835?
Check Price and Availability of 4191-0835, 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 4191-0835 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4191-0835
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4191-0835
  • 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 4191-0835 available by request