6486-0011 Screening compound: ethyl 4-{2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}benzoate

6486-0011 Screening compound: ethyl 4-{2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}benzoate
6486-0011 Screening compound: ethyl 4-{2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6486-0011
ethyl 4-{2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}benzoate

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

6486-0011

Molecular Formula

C22H21NO6 (C22 H21 NO6)

Compound Name

ethyl 4-{2-[(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}benzoate

IUPAC name

ethyl 4-{2-[(48-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}benzoate

SMILES

CCOC(c(cc1)ccc1NC(COc(cc1)c(C)c(O2)c1C(C)=CC2=O)=O)=O

InChI

InChI=1S/C22H21NO6/c1-4-27-22(26)15-5-7-16(8-6-15)23-19(24)12-28-18-10-9-17-13(2)11-20(25)29-21(17)14(18)3/h5-11H,4,12H2,1-3H3,(H,23,24)

InChI Key

PHRSPHVEARSKLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03660237

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.100

Distribution Coefficient, logD

4.100

Water Solubility, LogSw

-4.28

Polar Surface Area

71.547

Acid Dissociation Constant (pKa)

10.98

Base Dissociation Constant (pKb)

-1.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with 6486-0011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6486-0011?
Check Price and Availability of 6486-0011, 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 6486-0011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6486-0011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6486-0011
  • 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 6486-0011 available by request