2023-0439 Screening compound: 5-chloro-N-[2-(4-chlorophenoxy)ethyl]-2-nitroaniline

2023-0439 Screening compound: 5-chloro-N-[2-(4-chlorophenoxy)ethyl]-2-nitroaniline
2023-0439 Screening compound: 5-chloro-N-[2-(4-chlorophenoxy)ethyl]-2-nitroaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 2023-0439
5-chloro-N-[2-(4-chlorophenoxy)ethyl]-2-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

2023-0439

Molecular Formula

C14H12Cl2N2O3 (C14 H12 Cl2 N2 O3)

Compound Name

5-chloro-N-[2-(4-chlorophenoxy)ethyl]-2-nitroaniline

IUPAC name

5-chloro-N-[2-(4-chlorophenoxy)ethyl]-2-nitroaniline

SMILES

[O-][N+](c(ccc(Cl)c1)c1NCCOc(cc1)ccc1Cl)=O

InChI

InChI=1S/C14H12Cl2N2O3/c15-10-1-4-12(5-2-10)21-8-7-17-13-9-11(16)3-6-14(13)18(19)20/h1-6,9,17H,7-8H2

InChI Key

DNWQWLXTVMUDCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00763704

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.17

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.154

Distribution Coefficient, logD

5.154

Water Solubility, LogSw

-5.70

Polar Surface Area

50.115

Acid Dissociation Constant (pKa)

15.94

Base Dissociation Constant (pKb)

-1.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

2023-0439 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2023-0439 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2023-0439?
Check Price and Availability of 2023-0439, 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 2023-0439 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2023-0439
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2023-0439
  • 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 2023-0439 available by request