D579-0610 Screening compound: 2-[5-(3-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-(2,4,6-trimethylphenyl)propanamide

D579-0610 Screening compound: 2-[5-(3-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-(2,4,6-trimethylphenyl)propanamide
D579-0610 Screening compound: 2-[5-(3-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-(2,4,6-trimethylphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D579-0610
2-[5-(3-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-(2,4,6-trimethylphenyl)propanamide

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

D579-0610

Molecular Formula

C22H24N4O3 (C22 H24 N4 O3)

Compound Name

2-[5-(3-methoxyphenyl)-3-oxo-2,3-dihydro-1,2,4-triazin-2-yl]-N-(2,4,6-trimethylphenyl)propanamide

IUPAC name

2-[5-(3-methoxyphenyl)-3-oxo-23-dihydro-124-triazin-2-yl]-N-(246-trimethylphenyl)propanamide

SMILES

CC(C(Nc1c(C)cc(C)cc1C)=O)N1N=CC(c2cc(OC)ccc2)=NC1=O

InChI

InChI=1S/C22H24N4O3/c1-13-9-14(2)20(15(3)10-13)25-21(27)16(4)26-22(28)24-19(12-23-26)17-7-6-8-18(11-17)29-5/h6-12,16H,1-5H3,(H,25,27)/t16-/m0/s1

InChI Key

CVQKPOJGTKTYNV-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14859844

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.652

Distribution Coefficient, logD

3.641

Water Solubility, LogSw

-3.88

Polar Surface Area

65.106

Acid Dissociation Constant (pKa)

12.23

Base Dissociation Constant (pKb)

5.82

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

D579-0610 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

C-Met Library (15277 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D579-0610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D579-0610?
Check Price and Availability of D579-0610, 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 D579-0610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D579-0610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D579-0610
  • 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 D579-0610 available by request