E944-0439 Screening compound: ethyl 3-hydroxy-2-({3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}amino)propanoate

E944-0439 Screening compound: ethyl 3-hydroxy-2-({3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}amino)propanoate
E944-0439 Screening compound: ethyl 3-hydroxy-2-({3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}amino)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound E944-0439
ethyl 3-hydroxy-2-({3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}amino)propanoate

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

E944-0439

Molecular Formula

C11H14N4O4 (C11 H14 N4 O4)

Compound Name

ethyl 3-hydroxy-2-({3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl}amino)propanoate

IUPAC name

ethyl 3-hydroxy-2-({3-methyl-[12]oxazolo[54-d]pyrimidin-4-yl}amino)propanoate

SMILES

CCOC(C(CO)Nc1ncnc2c1c(C)no2)=O

InChI

InChI=1S/C11H14N4O4/c1-3-18-11(17)7(4-16)14-9-8-6(2)15-19-10(8)13-5-12-9/h5,7,16H,3-4H2,1-2H3,(H,12,13,14)/t7-/m0/s1

InChI Key

OVJXVBJCAZONPG-ZETCQYMHSA-N

MDL Number (MFCD)

MFCD14929232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

266.26

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.392

Distribution Coefficient, logD

0.392

Water Solubility, LogSw

-1.51

Polar Surface Area

90.872

Acid Dissociation Constant (pKa)

11.81

Base Dissociation Constant (pKb)

3.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.50

E944-0439 in Drug Discovery

Included in Screening Libraries

Nucleoside Mimetics Library (2197 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

New Agro Library (44492 compounds)

Purine Based Nucleoside Mimetics Library (1131 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Cancer
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Immune system
Structure:
  • Mimetics
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Targets:
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with E944-0439 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E944-0439?
Check Price and Availability of E944-0439, 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 E944-0439 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E944-0439
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E944-0439
  • 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 E944-0439 available by request