5450-0100 Screening compound: N,4-diamino-1,2,5-oxadiazole-3-carboximidamide

5450-0100 Screening compound: N,4-diamino-1,2,5-oxadiazole-3-carboximidamide
5450-0100 Screening compound: N,4-diamino-1,2,5-oxadiazole-3-carboximidamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5450-0100
N,4-diamino-1,2,5-oxadiazole-3-carboximidamide

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

5450-0100

Molecular Formula

C3H6N6O (C3 H6 N6 O)

Compound Name

N,4-diamino-1,2,5-oxadiazole-3-carboximidamide

IUPAC name

N4-diamino-125-oxadiazole-3-carboximidamide

SMILES

Nc1nonc1C(NN)=N

InChI

InChI=1S/C3H6N6O/c4-2(7-6)1-3(5)9-10-8-1/h6H2,(H2,4,7)(H2,5,9)

InChI Key

IUABABMIMWMKIV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00186406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

142.12

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

6.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-1.311

Distribution Coefficient, logD

-1.467

Water Solubility, LogSw

0.06

Polar Surface Area

110.340

Acid Dissociation Constant (pKa)

13.28

Base Dissociation Constant (pKb)

7.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 5450-0100 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5450-0100?
Check Price and Availability of 5450-0100, 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 5450-0100 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5450-0100
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5450-0100
  • 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 5450-0100 available by request