2746-0848 Screening compound: 2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate

2746-0848 Screening compound: 2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate
2746-0848 Screening compound: 2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2746-0848
2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate

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

2746-0848

Molecular Formula

C29H18ClN3O5 (C29 H18 ClN3 O5)

Compound Name

2-(4-chloro-3-nitrophenyl)-2-oxoethyl 2,3-diphenylquinoxaline-6-carboxylate

IUPAC name

2-(4-chloro-3-nitrophenyl)-2-oxoethyl 23-diphenylquinoxaline-6-carboxylate

SMILES

[O-][N+](c(cc(cc1)C(COC(c2cc3nc(-c4ccccc4)c(-c4ccccc4)nc3cc2)=O)=O)c1Cl)=O

InChI

InChI=1S/C29H18ClN3O5/c30-22-13-11-20(16-25(22)33(36)37)26(34)17-38-29(35)21-12-14-23-24(15-21)32-28(19-9-5-2-6-10-19)27(31-23)18-7-3-1-4-8-18/h1-16H,17H2

InChI Key

KCGBIECOJGCKQE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01885674

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

523.93

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

6.187

Distribution Coefficient, logD

6.187

Water Solubility, LogSw

-6.32

Polar Surface Area

85.354

Acid Dissociation Constant (pKa)

22.04

Base Dissociation Constant (pKb)

4.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.40

2746-0848 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 2746-0848 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2746-0848?
Check Price and Availability of 2746-0848, 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 2746-0848 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2746-0848
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2746-0848
  • 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 2746-0848 available by request