0490-5721 Screening compound: N-(5-bromopyridin-2-yl)-2-chloro-4-nitrobenzamide

0490-5721 Screening compound: N-(5-bromopyridin-2-yl)-2-chloro-4-nitrobenzamide
0490-5721 Screening compound: N-(5-bromopyridin-2-yl)-2-chloro-4-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0490-5721
N-(5-bromopyridin-2-yl)-2-chloro-4-nitrobenzamide

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

0490-5721

Molecular Formula

C12H7BrClN3O3 (C12 H7 BrClN3 O3)

Compound Name

N-(5-bromopyridin-2-yl)-2-chloro-4-nitrobenzamide

IUPAC name

N-(5-bromopyridin-2-yl)-2-chloro-4-nitrobenzamide

SMILES

[O-][N+](c(cc1)cc(Cl)c1C(Nc(cc1)ncc1Br)=O)=O

InChI

InChI=1S/C12H7BrClN3O3/c13-7-1-4-11(15-6-7)16-12(18)9-3-2-8(17(19)20)5-10(9)14/h1-6H,(H,15,16,18)

InChI Key

QGAFOOGEFTVOMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00805326

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.058

Distribution Coefficient, logD

3.013

Water Solubility, LogSw

-4.58

Polar Surface Area

66.416

Acid Dissociation Constant (pKa)

6.40

Base Dissociation Constant (pKb)

1.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0490-5721 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Frequent Hitters Library (7624 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0490-5721 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0490-5721?
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What is the minimum amount of 0490-5721 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0490-5721
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0490-5721
  • 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 0490-5721 available by request