K216-7701 Screening compound: 1-[2,3-bis(4-fluorophenyl)quinoxaline-6-carbonyl]piperidine-4-carboxamide

K216-7701 Screening compound: 1-[2,3-bis(4-fluorophenyl)quinoxaline-6-carbonyl]piperidine-4-carboxamide
K216-7701 Screening compound: 1-[2,3-bis(4-fluorophenyl)quinoxaline-6-carbonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K216-7701
1-[2,3-bis(4-fluorophenyl)quinoxaline-6-carbonyl]piperidine-4-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

K216-7701

Molecular Formula

C27H22F2N4O2 (C27 H22 F2 N4 O2)

Compound Name

1-[2,3-bis(4-fluorophenyl)quinoxaline-6-carbonyl]piperidine-4-carboxamide

IUPAC name

1-[23-bis(4-fluorophenyl)quinoxaline-6-carbonyl]piperidine-4-carboxamide

SMILES

NC(C(CC1)CCN1C(c1ccc2nc(-c(cc3)ccc3F)c(-c(cc3)ccc3F)nc2c1)=O)=O

InChI

InChI=1S/C27H22F2N4O2/c28-20-6-1-16(2-7-20)24-25(17-3-8-21(29)9-4-17)32-23-15-19(5-10-22(23)31-24)27(35)33-13-11-18(12-14-33)26(30)34/h1-10,15,18H,11-14H2,(H2,30,34)

InChI Key

YUASDFWDPDHNQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15081583

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.245

Distribution Coefficient, logD

3.245

Water Solubility, LogSw

-3.24

Polar Surface Area

68.876

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

3.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

K216-7701 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
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 K216-7701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K216-7701?
Check Price and Availability of K216-7701, 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 K216-7701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K216-7701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K216-7701
  • 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 K216-7701 available by request