D579-0130 Screening compound: N-(2,3-dichlorophenyl)-2-[5-(4-methylphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]acetamide

D579-0130 Screening compound: N-(2,3-dichlorophenyl)-2-[5-(4-methylphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]acetamide
D579-0130 Screening compound: N-(2,3-dichlorophenyl)-2-[5-(4-methylphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D579-0130
N-(2,3-dichlorophenyl)-2-[5-(4-methylphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]acetamide

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

D579-0130

Molecular Formula

C18H14Cl2N4O2 (C18 H14 Cl2 N4 O2)

Compound Name

N-(2,3-dichlorophenyl)-2-[5-(4-methylphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]acetamide

IUPAC name

N-(23-dichlorophenyl)-2-[5-(4-methylphenyl)-3-oxo-23-dihydro-124-triazin-2-yl]acetamide

SMILES

Cc(cc1)ccc1C(C=NN1CC(Nc2cccc(Cl)c2Cl)=O)=NC1=O

InChI

InChI=1S/C18H14Cl2N4O2/c1-11-5-7-12(8-6-11)15-9-21-24(18(26)23-15)10-16(25)22-14-4-2-3-13(19)17(14)20/h2-9H,10H2,1H3,(H,22,25)

InChI Key

ZEOJEXISUPFKMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14859765

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.039

Distribution Coefficient, logD

4.026

Water Solubility, LogSw

-4.38

Polar Surface Area

59.513

Acid Dissociation Constant (pKa)

9.32

Base Dissociation Constant (pKb)

5.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

D579-0130 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 D579-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D579-0130?
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What is the minimum amount of D579-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D579-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D579-0130
  • 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 D579-0130 available by request