0325-0401 Screening compound: 4-nitro-2,1,3-benzothiadiazole

0325-0401 Screening compound: 4-nitro-2,1,3-benzothiadiazole
0325-0401 Screening compound: 4-nitro-2,1,3-benzothiadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0325-0401
4-nitro-2,1,3-benzothiadiazole

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

0325-0401

Molecular Formula

C6H3N3O2S (C6 H3 N3 O2 S)

Compound Name

4-nitro-2,1,3-benzothiadiazole

IUPAC name

4-nitro-213-benzothiadiazole

SMILES

[O-][N+](c1cccc2nsnc12)=O

InChI

InChI=1S/C6H3N3O2S/c10-9(11)5-3-1-2-4-6(5)8-12-7-4/h1-3H

InChI Key

IWQKAMJGVIHECB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00068050

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

181.17

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.848

Distribution Coefficient, logD

1.848

Water Solubility, LogSw

-1.92

Polar Surface Area

54.272

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-3.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0325-0401 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0325-0401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0325-0401?
Check Price and Availability of 0325-0401, 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 0325-0401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0325-0401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0325-0401
  • 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 0325-0401 available by request