3329-3679 Screening compound: 5-[(2,6-dichlorophenyl)methylidene]-1,3-diazinane-2,4,6-trione

3329-3679 Screening compound: 5-[(2,6-dichlorophenyl)methylidene]-1,3-diazinane-2,4,6-trione
3329-3679 Screening compound: 5-[(2,6-dichlorophenyl)methylidene]-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3329-3679
5-[(2,6-dichlorophenyl)methylidene]-1,3-diazinane-2,4,6-trione

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

3329-3679

Molecular Formula

C11H6Cl2N2O3 (C11 H6 Cl2 N2 O3)

Compound Name

5-[(2,6-dichlorophenyl)methylidene]-1,3-diazinane-2,4,6-trione

IUPAC name

5-[(26-dichlorophenyl)methylidene]-13-diazinane-246-trione

SMILES

O=C(C(C(N1)=O)=Cc(c(Cl)ccc2)c2Cl)NC1=O

InChI

InChI=1S/C11H6Cl2N2O3/c12-7-2-1-3-8(13)5(7)4-6-9(16)14-11(18)15-10(6)17/h1-4H,(H2,14,15,16,17,18)

InChI Key

SQYOZZVSVQWNJN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00117964

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

285.09

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.242

Distribution Coefficient, logD

-0.730

Water Solubility, LogSw

-2.33

Polar Surface Area

62.643

Acid Dissociation Constant (pKa)

5.43

Base Dissociation Constant (pKb)

-8.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3329-3679 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

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

CORONAVIRUS Library (20774 compounds)

Human Kinases Annotated Library (2415 compounds)

PLpro Library (6343 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3329-3679 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3329-3679?
Check Price and Availability of 3329-3679, 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 3329-3679 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3329-3679
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3329-3679
  • 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 3329-3679 available by request