K784-1719 Screening compound: 3-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-7-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one

K784-1719 Screening compound: 3-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-7-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one
K784-1719 Screening compound: 3-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-7-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-1719
3-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-7-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one

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

K784-1719

Molecular Formula

C26H31N3O4S (C26 H31 N3 O4 S)

Compound Name

3-({[(2,5-dimethylphenyl)methyl]sulfanyl}methyl)-7-{1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl}-1,2,3,4-tetrahydroquinoxalin-2-one

IUPAC name

n/a

SMILES

Cc1cc(CSCC2Nc(ccc(C(N(CC3)CCC33OCCO3)=O)c3)c3NC2=O)c(C)cc1

InChI

InChI=1S/C26H31N3O4S/c1-17-3-4-18(2)20(13-17)15-34-16-23-24(30)28-22-14-19(5-6-21(22)27-23)25(31)29-9-7-26(8-10-29)32-11-12-33-26/h3-6,13-14,23,27H,7-12,15-16H2,1-2H3,(H,28,30)/t23-/m0/s1

InChI Key

LAMVZHSGSAEOQT-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD03019753

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.728

Distribution Coefficient, logD

3.728

Water Solubility, LogSw

-3.85

Polar Surface Area

68.183

Acid Dissociation Constant (pKa)

11.16

Base Dissociation Constant (pKb)

-0.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.20

K784-1719 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with K784-1719 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of K784-1719 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-1719
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-1719
  • 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 K784-1719 available by request