D579-0394 Screening compound: 2-[5-(4-chlorophenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-phenylacetamide

D579-0394 Screening compound: 2-[5-(4-chlorophenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-phenylacetamide
D579-0394 Screening compound: 2-[5-(4-chlorophenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D579-0394
2-[5-(4-chlorophenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-phenylacetamide

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

D579-0394

Molecular Formula

C17H13ClN4O2 (C17 H13 ClN4 O2)

Compound Name

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

IUPAC name

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

SMILES

O=C(CN1N=CC(c(cc2)ccc2Cl)=NC1=O)Nc1ccccc1

InChI

InChI=1S/C17H13ClN4O2/c18-13-8-6-12(7-9-13)15-10-19-22(17(24)21-15)11-16(23)20-14-4-2-1-3-5-14/h1-10H,11H2,(H,20,23)

InChI Key

LWRNVZZOXKDBQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27593773

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.77

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

3.022

Distribution Coefficient, logD

3.021

Water Solubility, LogSw

-3.65

Polar Surface Area

60.211

Acid Dissociation Constant (pKa)

13.08

Base Dissociation Constant (pKb)

4.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

D579-0394 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 D579-0394 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D579-0394?
Check Price and Availability of D579-0394, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D579-0394 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D579-0394
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D579-0394
  • 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 D579-0394 available by request