K784-1724 Screening compound: N-(2,2-dimethoxyethyl)-2-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

K784-1724 Screening compound: N-(2,2-dimethoxyethyl)-2-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
K784-1724 Screening compound: N-(2,2-dimethoxyethyl)-2-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-1724
N-(2,2-dimethoxyethyl)-2-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-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

K784-1724

Molecular Formula

C23H29N3O4S (C23 H29 N3 O4 S)

Compound Name

N-(2,2-dimethoxyethyl)-2-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-3-oxo-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

IUPAC name

N-(22-dimethoxyethyl)-2-({[(25-dimethylphenyl)methyl]sulfanyl}methyl)-3-oxo-1234-tetrahydroquinoxaline-6-carboxamide

SMILES

Cc1cc(CSCC2Nc(ccc(C(NCC(OC)OC)=O)c3)c3NC2=O)c(C)cc1

InChI

InChI=1S/C23H29N3O4S/c1-14-5-6-15(2)17(9-14)12-31-13-20-23(28)26-19-10-16(7-8-18(19)25-20)22(27)24-11-21(29-3)30-4/h5-10,20-21,25H,11-13H2,1-4H3,(H,24,27)(H,26,28)/t20-/m0/s1

InChI Key

HMSOEVKBLRDPRB-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD03019758

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.383

Distribution Coefficient, logD

3.383

Water Solubility, LogSw

-3.59

Polar Surface Area

77.277

Acid Dissociation Constant (pKa)

10.45

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

K784-1724 in Drug Discovery

Included in Screening Libraries

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

DGK Inhibitors Library (10558 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with K784-1724 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-1724?
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What is the minimum amount of K784-1724 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-1724
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-1724
  • 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 K784-1724 available by request