D579-0192 Screening compound: 2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-2,3-dihydro-1,2,4-triazin-3-one

D579-0192 Screening compound: 2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-2,3-dihydro-1,2,4-triazin-3-one
D579-0192 Screening compound: 2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-2,3-dihydro-1,2,4-triazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D579-0192
2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-2,3-dihydro-1,2,4-triazin-3-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

D579-0192

Molecular Formula

C20H18N4O2 (C20 H18 N4 O2)

Compound Name

2-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-2,3-dihydro-1,2,4-triazin-3-one

IUPAC name

2-[2-(23-dihydro-1H-indol-1-yl)-2-oxoethyl]-5-(4-methylphenyl)-23-dihydro-124-triazin-3-one

SMILES

Cc(cc1)ccc1C(C=NN1CC(N(CC2)c3c2cccc3)=O)=NC1=O

InChI

InChI=1S/C20H18N4O2/c1-14-6-8-15(9-7-14)17-12-21-24(20(26)22-17)13-19(25)23-11-10-16-4-2-3-5-18(16)23/h2-9,12H,10-11,13H2,1H3

InChI Key

HMZKQGBLTYLEFF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27593752

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.781

Distribution Coefficient, logD

2.746

Water Solubility, LogSw

-3.03

Polar Surface Area

52.484

Acid Dissociation Constant (pKa)

18.16

Base Dissociation Constant (pKb)

6.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

D579-0192 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Nervous system
  • Cardiovascular
Targets:
  • Kinases
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D579-0192 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D579-0192?
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What is the minimum amount of D579-0192 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D579-0192
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D579-0192
  • 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 D579-0192 available by request