0073-0057 Screening compound: 5-bromo-2-hydroxy-3-nitrobenzaldehyde

0073-0057 Screening compound: 5-bromo-2-hydroxy-3-nitrobenzaldehyde
0073-0057 Screening compound: 5-bromo-2-hydroxy-3-nitrobenzaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound 0073-0057
5-bromo-2-hydroxy-3-nitrobenzaldehyde

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

0073-0057

Molecular Formula

C7H4BrNO4 (C7 H4 BrNO4)

Compound Name

5-bromo-2-hydroxy-3-nitrobenzaldehyde

IUPAC name

5-bromo-2-hydroxy-3-nitrobenzaldehyde

SMILES

[O-][N+](c(cc(cc1C=O)Br)c1O)=O

InChI

InChI=1S/C7H4BrNO4/c8-5-1-4(3-10)7(11)6(2-5)9(12)13/h1-3,11H

InChI Key

YEYPSUQQZNDKDE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00130110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

246.02

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.559

Distribution Coefficient, logD

1.078

Water Solubility, LogSw

-2.36

Polar Surface Area

62.957

Acid Dissociation Constant (pKa)

5.93

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0073-0057 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 0073-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0073-0057?
Check Price and Availability of 0073-0057, 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 0073-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0073-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0073-0057
  • 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 0073-0057 available by request