Y040-4475 Screening compound: prop-2-en-1-yl 2-({7'-methoxy-2,2'-dioxo-2H,2'H-[3,4'-bichromen]-7-yl}oxy)acetate

Y040-4475 Screening compound: prop-2-en-1-yl 2-({7'-methoxy-2,2'-dioxo-2H,2'H-[3,4'-bichromen]-7-yl}oxy)acetate
Y040-4475 Screening compound: prop-2-en-1-yl 2-({7'-methoxy-2,2'-dioxo-2H,2'H-[3,4'-bichromen]-7-yl}oxy)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4475
prop-2-en-1-yl 2-({7'-methoxy-2,2'-dioxo-2H,2'H-[3,4'-bichromen]-7-yl}oxy)acetate

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

Y040-4475

Molecular Formula

C24H18O8 (C24 H18 O8)

Compound Name

prop-2-en-1-yl 2-({7'-methoxy-2,2'-dioxo-2H,2'H-[3,4'-bichromen]-7-yl}oxy)acetate

IUPAC name

prop-2-en-1-yl 2-({7'-methoxy-22'-dioxo-2H2'H-[34'-bichromen]-7-yl}oxy)acetate

SMILES

COc(cc1)cc(O2)c1C(C1=Cc(ccc(OCC(OCC=C)=O)c3)c3OC1=O)=CC2=O

InChI

InChI=1S/C24H18O8/c1-3-8-29-23(26)13-30-16-5-4-14-9-19(24(27)32-20(14)11-16)18-12-22(25)31-21-10-15(28-2)6-7-17(18)21/h3-7,9-12H,1,8,13H2,2H3

InChI Key

WEACQSZVSLZJLE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06494910

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.4

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.879

Distribution Coefficient, logD

2.879

Water Solubility, LogSw

-3.36

Polar Surface Area

76.792

Acid Dissociation Constant (pKa)

24.27

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

Y040-4475 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y040-4475 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4475?
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What is the minimum amount of Y040-4475 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4475
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4475
  • 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 Y040-4475 available by request