0584-0556 Screening compound: 4-nitrobenzene-1,3-diamine

0584-0556 Screening compound: 4-nitrobenzene-1,3-diamine
0584-0556 Screening compound: 4-nitrobenzene-1,3-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0584-0556
4-nitrobenzene-1,3-diamine

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

0584-0556

Molecular Formula

C6H7N3O2 (C6 H7 N3 O2)

Compound Name

4-nitrobenzene-1,3-diamine

IUPAC name

4-nitrobenzene-13-diamine

SMILES

Nc(cc1)cc(N)c1[N+]([O-])=O

InChI

InChI=1S/C6H7N3O2/c7-4-1-2-6(9(10)11)5(8)3-4/h1-3H,7-8H2

InChI Key

DPIZKMGPXNXSGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00025289

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

153.14

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.365

Distribution Coefficient, logD

0.365

Water Solubility, LogSw

-1.68

Polar Surface Area

74.221

Acid Dissociation Constant (pKa)

19.14

Base Dissociation Constant (pKb)

1.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0584-0556 in Drug Discovery

Included in Screening Libraries

Human Receptors Annotated Library (5376 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0584-0556 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0584-0556?
Check Price and Availability of 0584-0556, 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 0584-0556 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0584-0556
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0584-0556
  • 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 0584-0556 available by request