D579-0408 Screening compound: 2-[5-(4-chlorophenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-(3-methylphenyl)acetamide

D579-0408 Screening compound: 2-[5-(4-chlorophenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-(3-methylphenyl)acetamide
D579-0408 Screening compound: 2-[5-(4-chlorophenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-(3-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D579-0408
2-[5-(4-chlorophenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-(3-methylphenyl)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

D579-0408

Molecular Formula

C18H15ClN4O2 (C18 H15 ClN4 O2)

Compound Name

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

IUPAC name

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

SMILES

Cc1cccc(NC(CN2N=CC(c(cc3)ccc3Cl)=NC2=O)=O)c1

InChI

InChI=1S/C18H15ClN4O2/c1-12-3-2-4-15(9-12)21-17(24)11-23-18(25)22-16(10-20-23)13-5-7-14(19)8-6-13/h2-10H,11H2,1H3,(H,21,24)

InChI Key

GLEFWKCLGRORLG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27593777

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.8

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

3.574

Distribution Coefficient, logD

3.573

Water Solubility, LogSw

-3.94

Polar Surface Area

60.211

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

4.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

D579-0408 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 D579-0408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D579-0408?
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What is the minimum amount of D579-0408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D579-0408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D579-0408
  • 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 D579-0408 available by request