1822-0054 Screening compound: 2-bromo-6-chloro-4-nitroaniline

1822-0054 Screening compound: 2-bromo-6-chloro-4-nitroaniline
1822-0054 Screening compound: 2-bromo-6-chloro-4-nitroaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 1822-0054
2-bromo-6-chloro-4-nitroaniline

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

1822-0054

Molecular Formula

C6H4BrClN2O2 (C6 H4 BrClN2 O2)

Compound Name

2-bromo-6-chloro-4-nitroaniline

IUPAC name

2-bromo-6-chloro-4-nitroaniline

SMILES

Nc(c(Cl)cc([N+]([O-])=O)c1)c1Br

InChI

InChI=1S/C6H4BrClN2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2

InChI Key

GLUCALKKMFBJEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00014770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

251.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.945

Distribution Coefficient, logD

2.945

Water Solubility, LogSw

-3.35

Polar Surface Area

53.006

Acid Dissociation Constant (pKa)

16.62

Base Dissociation Constant (pKb)

-2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1822-0054 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1822-0054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1822-0054?
Check Price and Availability of 1822-0054, 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 1822-0054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1822-0054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1822-0054
  • 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 1822-0054 available by request