Y040-0856 Screening compound: 3-[2-(3-methoxyphenyl)-2-oxoethoxy]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-one

Y040-0856 Screening compound: 3-[2-(3-methoxyphenyl)-2-oxoethoxy]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-one
Y040-0856 Screening compound: 3-[2-(3-methoxyphenyl)-2-oxoethoxy]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-0856
3-[2-(3-methoxyphenyl)-2-oxoethoxy]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-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

Y040-0856

Molecular Formula

C23H22O5 (C23 H22 O5)

Compound Name

3-[2-(3-methoxyphenyl)-2-oxoethoxy]-6H,7H,8H,9H,10H,11H-cyclohepta[c]chromen-6-one

IUPAC name

3-[2-(3-methoxyphenyl)-2-oxoethoxy]-6H7H8H9H10H11H-cyclohepta[c]chromen-6-one

SMILES

COc1cccc(C(COc(cc2)cc(O3)c2C(CCCCC2)=C2C3=O)=O)c1

InChI

InChI=1S/C23H22O5/c1-26-16-7-5-6-15(12-16)21(24)14-27-17-10-11-19-18-8-3-2-4-9-20(18)23(25)28-22(19)13-17/h5-7,10-13H,2-4,8-9,14H2,1H3

InChI Key

ATEWYTCXYDTNPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03993929

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.860

Distribution Coefficient, logD

4.860

Water Solubility, LogSw

-4.69

Polar Surface Area

49.430

Acid Dissociation Constant (pKa)

22.29

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with Y040-0856 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-0856?
Check Price and Availability of Y040-0856, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y040-0856 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-0856
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-0856
  • 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 Y040-0856 available by request