K216-8504 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-2,3-bis(3-methylphenyl)quinoxaline-6-carboxamide

K216-8504 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-2,3-bis(3-methylphenyl)quinoxaline-6-carboxamide
K216-8504 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-2,3-bis(3-methylphenyl)quinoxaline-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K216-8504
N-{[4-(dimethylamino)phenyl]methyl}-2,3-bis(3-methylphenyl)quinoxaline-6-carboxamide

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

K216-8504

Molecular Formula

C32H30N4O (C32 H30 N4 O)

Compound Name

N-{[4-(dimethylamino)phenyl]methyl}-2,3-bis(3-methylphenyl)quinoxaline-6-carboxamide

IUPAC name

N-{[4-(dimethylamino)phenyl]methyl}-23-bis(3-methylphenyl)quinoxaline-6-carboxamide

SMILES

Cc1cccc(-c2c(-c3cc(C)ccc3)nc(cc(cc3)C(NCc(cc4)ccc4N(C)C)=O)c3n2)c1

InChI

InChI=1S/C32H30N4O/c1-21-7-5-9-24(17-21)30-31(25-10-6-8-22(2)18-25)35-29-19-26(13-16-28(29)34-30)32(37)33-20-23-11-14-27(15-12-23)36(3)4/h5-19H,20H2,1-4H3,(H,33,37)

InChI Key

MSOBJRVBFBLLLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15081692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.62

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.481

Distribution Coefficient, logD

6.465

Water Solubility, LogSw

-5.65

Polar Surface Area

45.387

Acid Dissociation Constant (pKa)

12.46

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.60

K216-8504 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with K216-8504 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K216-8504?
Check Price and Availability of K216-8504, 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 K216-8504 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K216-8504
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K216-8504
  • 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 K216-8504 available by request