0488-0494 Screening compound: 3-amino-1-(4-amino-1,2,5-oxadiazol-3-yl)urea

0488-0494 Screening compound: 3-amino-1-(4-amino-1,2,5-oxadiazol-3-yl)urea
0488-0494 Screening compound: 3-amino-1-(4-amino-1,2,5-oxadiazol-3-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 0488-0494
3-amino-1-(4-amino-1,2,5-oxadiazol-3-yl)urea

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

0488-0494

Molecular Formula

C3H6N6O2 (C3 H6 N6 O2)

Compound Name

3-amino-1-(4-amino-1,2,5-oxadiazol-3-yl)urea

IUPAC name

3-amino-1-(4-amino-125-oxadiazol-3-yl)urea

SMILES

Nc1nonc1NC(NN)=O

InChI

InChI=1S/C3H6N6O2/c4-1-2(9-11-8-1)6-3(10)7-5/h5H2,(H2,4,8)(H2,6,7,9,10)

InChI Key

VJFIHHWMZLEQCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00604310

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

158.12

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

6.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-1.714

Distribution Coefficient, logD

-1.852

Water Solubility, LogSw

-1.04

Polar Surface Area

115.310

Acid Dissociation Constant (pKa)

7.83

Base Dissociation Constant (pKb)

4.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0488-0494 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Immune system
Agro:
  • Agro
Targets:
  • Proteases
  • Others

References: we are preparing a list of scientific research reports with 0488-0494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0488-0494?
Check Price and Availability of 0488-0494, 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 0488-0494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0488-0494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0488-0494
  • 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 0488-0494 available by request