Y040-1772 Screening compound: 7-(benzyloxy)-3,4-dimethyl-2H-chromen-2-one

Y040-1772 Screening compound: 7-(benzyloxy)-3,4-dimethyl-2H-chromen-2-one
Y040-1772 Screening compound: 7-(benzyloxy)-3,4-dimethyl-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-1772
7-(benzyloxy)-3,4-dimethyl-2H-chromen-2-one

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

Y040-1772

Molecular Formula

C18H16O3 (C18 H16 O3)

Compound Name

7-(benzyloxy)-3,4-dimethyl-2H-chromen-2-one

IUPAC name

7-(benzyloxy)-34-dimethyl-2H-chromen-2-one

SMILES

CC(c(ccc(OCc1ccccc1)c1)c1O1)=C(C)C1=O

InChI

InChI=1S/C18H16O3/c1-12-13(2)18(19)21-17-10-15(8-9-16(12)17)20-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3

InChI Key

OLKYAFAQLVOQDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02955651

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.992

Distribution Coefficient, logD

3.992

Water Solubility, LogSw

-4.47

Polar Surface Area

28.388

Acid Dissociation Constant (pKa)

29.40

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

Y040-1772 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

STING Agonist Library (5895 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Immune system
Targets:
  • Kinases
  • Others

References: we are preparing a list of scientific research reports with Y040-1772 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-1772?
Check Price and Availability of Y040-1772, 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 Y040-1772 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-1772
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-1772
  • 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 Y040-1772 available by request