Y040-2593 Screening compound: 2-{7-[(2,4-dichlorophenyl)methoxy]-4-methyl-2-oxo-2H-chromen-3-yl}acetic acid

Y040-2593 Screening compound: 2-{7-[(2,4-dichlorophenyl)methoxy]-4-methyl-2-oxo-2H-chromen-3-yl}acetic acid
Y040-2593 Screening compound: 2-{7-[(2,4-dichlorophenyl)methoxy]-4-methyl-2-oxo-2H-chromen-3-yl}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-2593
2-{7-[(2,4-dichlorophenyl)methoxy]-4-methyl-2-oxo-2H-chromen-3-yl}acetic acid

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

Y040-2593

Molecular Formula

C19H14Cl2O5 (C19 H14 Cl2 O5)

Compound Name

2-{7-[(2,4-dichlorophenyl)methoxy]-4-methyl-2-oxo-2H-chromen-3-yl}acetic acid

IUPAC name

2-{7-[(24-dichlorophenyl)methoxy]-4-methyl-2-oxo-2H-chromen-3-yl}acetic acid

SMILES

CC(c(ccc(OCc(ccc(Cl)c1)c1Cl)c1)c1O1)=C(CC(O)=O)C1=O

InChI

InChI=1S/C19H14Cl2O5/c1-10-14-5-4-13(25-9-11-2-3-12(20)6-16(11)21)7-17(14)26-19(24)15(10)8-18(22)23/h2-7H,8-9H2,1H3,(H,22,23)

InChI Key

KPZDXPULUYKPQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03853666

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.22

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.301

Distribution Coefficient, logD

0.842

Water Solubility, LogSw

-4.32

Polar Surface Area

56.772

Acid Dissociation Constant (pKa)

3.94

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

Y040-2593 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 Y040-2593 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-2593?
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What is the minimum amount of Y040-2593 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-2593
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-2593
  • 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 Y040-2593 available by request