4721-0162 Screening compound: N-(3-methylbutyl)-N'-phenylethanediamide

4721-0162 Screening compound: N-(3-methylbutyl)-N'-phenylethanediamide
4721-0162 Screening compound: N-(3-methylbutyl)-N'-phenylethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4721-0162
N-(3-methylbutyl)-N'-phenylethanediamide

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

4721-0162

Molecular Formula

C13H18N2O2 (C13 H18 N2 O2)

Compound Name

N-(3-methylbutyl)-N'-phenylethanediamide

IUPAC name

N-(3-methylbutyl)-N'-phenylethanediamide

SMILES

CC(C)CCNC(C(Nc1ccccc1)=O)=O

InChI

InChI=1S/C13H18N2O2/c1-10(2)8-9-14-12(16)13(17)15-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,14,16)(H,15,17)

InChI Key

WGUAXYIROGEPDF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00712801

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

234.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.019

Distribution Coefficient, logD

1.926

Water Solubility, LogSw

-2.53

Polar Surface Area

48.128

Acid Dissociation Constant (pKa)

8.02

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.50

4721-0162 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4721-0162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4721-0162?
Check Price and Availability of 4721-0162, 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 4721-0162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4721-0162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4721-0162
  • 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 4721-0162 available by request