2277-0005 Screening compound: (5E)-5-[(furan-2-yl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione

2277-0005 Screening compound: (5E)-5-[(furan-2-yl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione
2277-0005 Screening compound: (5E)-5-[(furan-2-yl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2277-0005
(5E)-5-[(furan-2-yl)methylidene]-1-phenyl-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

2277-0005

Molecular Formula

C15H10N2O4 (C15 H10 N2 O4)

Compound Name

(5E)-5-[(furan-2-yl)methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione

IUPAC name

(5E)-5-[(furan-2-yl)methylidene]-1-phenyl-13-diazinane-246-trione

SMILES

O=C(/C(/C(N1c2ccccc2)=O)=C\c2ccco2)NC1=O

InChI

InChI=1S/C15H10N2O4/c18-13-12(9-11-7-4-8-21-11)14(19)17(15(20)16-13)10-5-2-1-3-6-10/h1-9H,(H,16,18,20)

InChI Key

NRTWAQJCJBUTAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00552472

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.26

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.404

Distribution Coefficient, logD

1.092

Water Solubility, LogSw

-1.76

Polar Surface Area

61.139

Acid Dissociation Constant (pKa)

7.38

Base Dissociation Constant (pKb)

-6.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2277-0005 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

Human Proteases Annotated Library (2868 compounds)

Human Receptors Annotated Library (5376 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2277-0005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2277-0005?
Check Price and Availability of 2277-0005, 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 2277-0005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2277-0005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2277-0005
  • 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 2277-0005 available by request