K784-7098 Screening compound: 2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

K784-7098 Screening compound: 2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
K784-7098 Screening compound: 2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-7098
2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-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

K784-7098

Molecular Formula

C22H25ClFN3O5S (C22 H25 ClFN3 O5 S)

Compound Name

2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

IUPAC name

2-{[(2-chloro-4-fluorophenyl)methanesulfonyl]methyl}-N-(3-ethoxypropyl)-3-oxo-1234-tetrahydroquinoxaline-6-carboxamide

SMILES

CCOCCCNC(c(cc1)cc(N2)c1NC(CS(Cc(ccc(F)c1)c1Cl)(=O)=O)C2=O)=O

InChI

InChI=1S/C22H25ClFN3O5S/c1-2-32-9-3-8-25-21(28)14-5-7-18-19(10-14)27-22(29)20(26-18)13-33(30,31)12-15-4-6-16(24)11-17(15)23/h4-7,10-11,20,26H,2-3,8-9,12-13H2,1H3,(H,25,28)(H,27,29)/t20-/m0/s1

InChI Key

BCNDWQHKQMZYFB-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD15098676

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.97

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.423

Distribution Coefficient, logD

2.423

Water Solubility, LogSw

-3.38

Polar Surface Area

97.902

Acid Dissociation Constant (pKa)

10.45

Base Dissociation Constant (pKb)

-0.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

K784-7098 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K784-7098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-7098?
Check Price and Availability of K784-7098, 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 K784-7098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-7098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-7098
  • 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 K784-7098 available by request