Y041-2529 Screening compound: (2Z)-6-[(3,4-dichlorophenyl)methoxy]-2-[(2,4,5-trimethoxyphenyl)methylidene]-2,3-dihydro-1-benzofuran-3-one

Y041-2529 Screening compound: (2Z)-6-[(3,4-dichlorophenyl)methoxy]-2-[(2,4,5-trimethoxyphenyl)methylidene]-2,3-dihydro-1-benzofuran-3-one
Y041-2529 Screening compound: (2Z)-6-[(3,4-dichlorophenyl)methoxy]-2-[(2,4,5-trimethoxyphenyl)methylidene]-2,3-dihydro-1-benzofuran-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-2529
(2Z)-6-[(3,4-dichlorophenyl)methoxy]-2-[(2,4,5-trimethoxyphenyl)methylidene]-2,3-dihydro-1-benzofuran-3-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

Y041-2529

Molecular Formula

C25H20Cl2O6 (C25 H20 Cl2 O6)

Compound Name

(2Z)-6-[(3,4-dichlorophenyl)methoxy]-2-[(2,4,5-trimethoxyphenyl)methylidene]-2,3-dihydro-1-benzofuran-3-one

IUPAC name

(2Z)-6-[(34-dichlorophenyl)methoxy]-2-[(245-trimethoxyphenyl)methylidene]-23-dihydro-1-benzofuran-3-one

SMILES

COc(cc1OC)c(/C=C2\Oc(cc(cc3)OCc(cc4)cc(Cl)c4Cl)c3C2=O)cc1OC

InChI

InChI=1S/C25H20Cl2O6/c1-29-20-12-23(31-3)22(30-2)9-15(20)10-24-25(28)17-6-5-16(11-21(17)33-24)32-13-14-4-7-18(26)19(27)8-14/h4-12H,13H2,1-3H3

InChI Key

UQRJKMSGFTZONK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04182768

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.34

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.756

Distribution Coefficient, logD

5.756

Water Solubility, LogSw

-6.04

Polar Surface Area

51.482

Acid Dissociation Constant (pKa)

28.55

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

References: we are preparing a list of scientific research reports with Y041-2529 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-2529?
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What is the minimum amount of Y041-2529 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-2529
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-2529
  • 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 Y041-2529 available by request