0994-0118 Screening compound: 6-[(2,3-diphenylquinoxalin-6-yl)methyl]-2,3-diphenylquinoxaline

0994-0118 Screening compound: 6-[(2,3-diphenylquinoxalin-6-yl)methyl]-2,3-diphenylquinoxaline
0994-0118 Screening compound: 6-[(2,3-diphenylquinoxalin-6-yl)methyl]-2,3-diphenylquinoxaline alternative view

Chemical Structure Depiction of ChemDiv screening compound 0994-0118
6-[(2,3-diphenylquinoxalin-6-yl)methyl]-2,3-diphenylquinoxaline

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

0994-0118

Molecular Formula

C41H28N4 (C41 H28 N4)

Compound Name

6-[(2,3-diphenylquinoxalin-6-yl)methyl]-2,3-diphenylquinoxaline

IUPAC name

6-[(23-diphenylquinoxalin-6-yl)methyl]-23-diphenylquinoxaline

SMILES

C(c1cc2nc(-c3ccccc3)c(-c3ccccc3)nc2cc1)c1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1

InChI

InChI=1S/C41H28N4/c1-5-13-30(14-6-1)38-40(32-17-9-3-10-18-32)44-36-26-28(21-23-34(36)42-38)25-29-22-24-35-37(27-29)45-41(33-19-11-4-12-20-33)39(43-35)31-15-7-2-8-16-31/h1-24,26-27H,25H2

InChI Key

PJNBCNKXROVAKU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00223639

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

576.7

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

8.887

Distribution Coefficient, logD

8.887

Water Solubility, LogSw

-6.46

Polar Surface Area

35.828

Acid Dissociation Constant (pKa)

22.70

Base Dissociation Constant (pKb)

4.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

2.40

0994-0118 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CORONAVIRUS Library (20774 compounds)

Frequent Hitters Library (7624 compounds)

PLpro Library (6343 compounds)

Akt-Targeted Library (14764 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Structure:
  • Pool
Targets:
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with 0994-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0994-0118?
Check Price and Availability of 0994-0118, 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 0994-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0994-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0994-0118
  • 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 0994-0118 available by request