8011-8432 Screening compound: N~1~-[2-(2-chloro-6-nitroanilino)ethyl]-4-methylbenzamide

8011-8432 Screening compound: N~1~-[2-(2-chloro-6-nitroanilino)ethyl]-4-methylbenzamide
8011-8432 Screening compound: N~1~-[2-(2-chloro-6-nitroanilino)ethyl]-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-8432
N~1~-[2-(2-chloro-6-nitroanilino)ethyl]-4-methylbenzamide

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

8011-8432

Molecular Formula

C16H16ClN3O3 (C16 H16 ClN3 O3)

Compound Name

N~1~-[2-(2-chloro-6-nitroanilino)ethyl]-4-methylbenzamide

IUPAC name

N-{2-[(2-chloro-6-nitrophenyl)amino]ethyl}-4-methylbenzamide

SMILES

Cc(cc1)ccc1C(NCCNc(c([N+]([O-])=O)ccc1)c1Cl)=O

InChI

InChI=1S/C16H16ClN3O3/c1-11-5-7-12(8-6-11)16(21)19-10-9-18-15-13(17)3-2-4-14(15)20(22)23/h2-8,18H,9-10H2,1H3,(H,19,21)

InChI Key

ARWXFZDWSFUSAW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02625986

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.77

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.061

Distribution Coefficient, logD

3.061

Water Solubility, LogSw

-3.55

Polar Surface Area

66.526

Acid Dissociation Constant (pKa)

13.31

Base Dissociation Constant (pKb)

-2.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

8011-8432 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8011-8432 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-8432?
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What is the minimum amount of 8011-8432 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-8432
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-8432
  • 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 8011-8432 available by request