Y040-0978 Screening compound: 7-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethoxy]-6-chloro-4-phenyl-2H-chromen-2-one

Y040-0978 Screening compound: 7-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethoxy]-6-chloro-4-phenyl-2H-chromen-2-one
Y040-0978 Screening compound: 7-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethoxy]-6-chloro-4-phenyl-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-0978
7-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethoxy]-6-chloro-4-phenyl-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

Y040-0978

Molecular Formula

C24H15ClO6 (C24 H15 ClO6)

Compound Name

7-[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethoxy]-6-chloro-4-phenyl-2H-chromen-2-one

IUPAC name

7-[2-(2H-13-benzodioxol-5-yl)-2-oxoethoxy]-6-chloro-4-phenyl-2H-chromen-2-one

SMILES

O=C(COc(cc(c(C(c1ccccc1)=C1)c2)OC1=O)c2Cl)c(cc1)cc2c1OCO2

InChI

InChI=1S/C24H15ClO6/c25-18-9-17-16(14-4-2-1-3-5-14)10-24(27)31-21(17)11-22(18)28-12-19(26)15-6-7-20-23(8-15)30-13-29-20/h1-11H,12-13H2

InChI Key

RZSSXYGQDNLHOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10040515

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.83

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.065

Distribution Coefficient, logD

5.065

Water Solubility, LogSw

-5.32

Polar Surface Area

58.051

Acid Dissociation Constant (pKa)

22.29

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

Y040-0978 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Autophagy-Targeted Library (4564 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with Y040-0978 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-0978?
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What is the minimum amount of Y040-0978 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-0978
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-0978
  • 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 Y040-0978 available by request