D579-0170 Screening compound: N-(2,5-dimethylphenyl)-2-[5-(4-methylphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]acetamide

D579-0170 Screening compound: N-(2,5-dimethylphenyl)-2-[5-(4-methylphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]acetamide
D579-0170 Screening compound: N-(2,5-dimethylphenyl)-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 D579-0170
N-(2,5-dimethylphenyl)-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

D579-0170

Molecular Formula

C20H20N4O2 (C20 H20 N4 O2)

Compound Name

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

IUPAC name

N-(25-dimethylphenyl)-2-[5-(4-methylphenyl)-3-oxo-23-dihydro-124-triazin-2-yl]acetamide

SMILES

Cc(cc1)ccc1C(C=NN1CC(Nc2c(C)ccc(C)c2)=O)=NC1=O

InChI

InChI=1S/C20H20N4O2/c1-13-5-8-16(9-6-13)18-11-21-24(20(26)23-18)12-19(25)22-17-10-14(2)4-7-15(17)3/h4-11H,12H2,1-3H3,(H,22,25)

InChI Key

BHNJIBURGJNHIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27593739

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.4

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

3.084

Distribution Coefficient, logD

3.076

Water Solubility, LogSw

-2.98

Polar Surface Area

59.513

Acid Dissociation Constant (pKa)

13.03

Base Dissociation Constant (pKb)

5.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

D579-0170 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D579-0170 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D579-0170?
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What is the minimum amount of D579-0170 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D579-0170
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D579-0170
  • 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 D579-0170 available by request