Y041-4240 Screening compound: 7-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethoxy]-3,4-dimethyl-2H-chromen-2-one

Y041-4240 Screening compound: 7-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethoxy]-3,4-dimethyl-2H-chromen-2-one
Y041-4240 Screening compound: 7-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethoxy]-3,4-dimethyl-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-4240
7-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethoxy]-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

Y041-4240

Molecular Formula

C21H18O6 (C21 H18 O6)

Compound Name

7-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethoxy]-3,4-dimethyl-2H-chromen-2-one

IUPAC name

7-[2-(23-dihydro-14-benzodioxin-6-yl)-2-oxoethoxy]-34-dimethyl-2H-chromen-2-one

SMILES

CC(c(ccc(OCC(c(cc1)cc2c1OCCO2)=O)c1)c1O1)=C(C)C1=O

InChI

InChI=1S/C21H18O6/c1-12-13(2)21(23)27-19-10-15(4-5-16(12)19)26-11-17(22)14-3-6-18-20(9-14)25-8-7-24-18/h3-6,9-10H,7-8,11H2,1-2H3

InChI Key

AMTOQNWEASNABT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27961348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.702

Distribution Coefficient, logD

2.702

Water Solubility, LogSw

-3.08

Polar Surface Area

57.458

Acid Dissociation Constant (pKa)

22.29

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

Y041-4240 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y041-4240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-4240?
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What is the minimum amount of Y041-4240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-4240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-4240
  • 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 Y041-4240 available by request