Y204-0580 Screening compound: N~1~,N~5~-bis(3-ethylphenyl)pentanediamide

Y204-0580 Screening compound: N~1~,N~5~-bis(3-ethylphenyl)pentanediamide
Y204-0580 Screening compound: N~1~,N~5~-bis(3-ethylphenyl)pentanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y204-0580
N~1~,N~5~-bis(3-ethylphenyl)pentanediamide

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

Y204-0580

Molecular Formula

C21H26N2O2 (C21 H26 N2 O2)

Compound Name

N~1~,N~5~-bis(3-ethylphenyl)pentanediamide

IUPAC name

NN'-bis(3-ethylphenyl)pentanediamide

SMILES

CCc1cccc(NC(CCCC(Nc2cc(CC)ccc2)=O)=O)c1

InChI

InChI=1S/C21H26N2O2/c1-3-16-8-5-10-18(14-16)22-20(24)12-7-13-21(25)23-19-11-6-9-17(4-2)15-19/h5-6,8-11,14-15H,3-4,7,12-13H2,1-2H3,(H,22,24)(H,23,25)

InChI Key

LRUCRKFUDKFKNF-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.997

Distribution Coefficient, logD

3.997

Water Solubility, LogSw

-4.06

Polar Surface Area

46.266

Acid Dissociation Constant (pKa)

12.73

Base Dissociation Constant (pKb)

2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

Y204-0580 in Drug Discovery

Included in Screening Libraries

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y204-0580 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y204-0580?
Check Price and Availability of Y204-0580, 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 Y204-0580 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y204-0580
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y204-0580
  • 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 Y204-0580 available by request