4973-0704 Screening compound: N-benzyl-2-{[3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetamide

4973-0704 Screening compound: N-benzyl-2-{[3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetamide
4973-0704 Screening compound: N-benzyl-2-{[3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4973-0704
N-benzyl-2-{[3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetamide

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

4973-0704

Molecular Formula

C26H23NO5 (C26 H23 NO5)

Compound Name

N-benzyl-2-{[3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetamide

IUPAC name

N-benzyl-2-{[3-(35-dimethylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetamide

SMILES

Cc1cc(OC2=COc(cc(cc3)OCC(NCc4ccccc4)=O)c3C2=O)cc(C)c1

InChI

InChI=1S/C26H23NO5/c1-17-10-18(2)12-21(11-17)32-24-15-31-23-13-20(8-9-22(23)26(24)29)30-16-25(28)27-14-19-6-4-3-5-7-19/h3-13,15H,14,16H2,1-2H3,(H,27,28)

InChI Key

KPUOKGZRWSLFFL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03030014

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.377

Distribution Coefficient, logD

4.377

Water Solubility, LogSw

-4.47

Polar Surface Area

59.269

Acid Dissociation Constant (pKa)

13.15

Base Dissociation Constant (pKb)

-1.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 4973-0704 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4973-0704?
Check Price and Availability of 4973-0704, 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 4973-0704 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4973-0704
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4973-0704
  • 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 4973-0704 available by request