K216-1342 Screening compound: 2,3-bis(3-methylphenyl)-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoxaline

K216-1342 Screening compound: 2,3-bis(3-methylphenyl)-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoxaline
K216-1342 Screening compound: 2,3-bis(3-methylphenyl)-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoxaline alternative view

Chemical Structure Depiction of ChemDiv screening compound K216-1342
2,3-bis(3-methylphenyl)-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoxaline

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

K216-1342

Molecular Formula

C31H28N6O (C31 H28 N6 O)

Compound Name

2,3-bis(3-methylphenyl)-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoxaline

IUPAC name

23-bis(3-methylphenyl)-6-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]quinoxaline

SMILES

Cc1cccc(-c2c(-c3cc(C)ccc3)nc(cc(cc3)C(N(CC4)CCN4c4ncccn4)=O)c3n2)c1

InChI

InChI=1S/C31H28N6O/c1-21-6-3-8-23(18-21)28-29(24-9-4-7-22(2)19-24)35-27-20-25(10-11-26(27)34-28)30(38)36-14-16-37(17-15-36)31-32-12-5-13-33-31/h3-13,18-20H,14-17H2,1-2H3

InChI Key

PCKOUILTBHUXAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15081400

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

500.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.522

Distribution Coefficient, logD

5.520

Water Solubility, LogSw

-5.44

Polar Surface Area

56.440

Acid Dissociation Constant (pKa)

21.00

Base Dissociation Constant (pKb)

4.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.40

K216-1342 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K216-1342 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K216-1342?
Check Price and Availability of K216-1342, 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 K216-1342 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K216-1342
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K216-1342
  • 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 K216-1342 available by request