Y041-4571 Screening compound: 2-{[(benzyloxy)carbonyl]amino}pentanedioic acid

Y041-4571 Screening compound: 2-{[(benzyloxy)carbonyl]amino}pentanedioic acid
Y041-4571 Screening compound: 2-{[(benzyloxy)carbonyl]amino}pentanedioic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-4571
2-{[(benzyloxy)carbonyl]amino}pentanedioic acid

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

Y041-4571

Molecular Formula

C13H15NO6 (C13 H15 NO6)

Compound Name

2-{[(benzyloxy)carbonyl]amino}pentanedioic acid

IUPAC name

(2S)-2-{[(benzyloxy)carbonyl]amino}pentanedioic acid

SMILES

OC(CCC(C(O)=O)NC(OCc1ccccc1)=O)=O

InChI

InChI=1S/C13H15NO6/c15-11(16)7-6-10(12(17)18)14-13(19)20-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,14,19)(H,15,16)(H,17,18)/t10-/m0/s1

InChI Key

PVFCXMDXBIEMQG-JTQLQIEISA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

281.27

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.424

Distribution Coefficient, logD

-3.135

Water Solubility, LogSw

-1.44

Polar Surface Area

89.802

Acid Dissociation Constant (pKa)

3.84

Base Dissociation Constant (pKb)

-1.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.77

Y041-4571 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CORONAVIRUS Library (20774 compounds)

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y041-4571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-4571?
Check Price and Availability of Y041-4571, 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 Y041-4571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-4571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-4571
  • 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 Y041-4571 available by request