Y040-8500 Screening compound: 2-[2-(2-{2-[(4-ethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}acetamido)acetamido]acetic acid

Y040-8500 Screening compound: 2-[2-(2-{2-[(4-ethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}acetamido)acetamido]acetic acid
Y040-8500 Screening compound: 2-[2-(2-{2-[(4-ethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}acetamido)acetamido]acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-8500
2-[2-(2-{2-[(4-ethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}acetamido)acetamido]acetic acid

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

Y040-8500

Molecular Formula

C19H21N3O8 (C19 H21 N3 O8)

Compound Name

2-[2-(2-{2-[(4-ethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}acetamido)acetamido]acetic acid

IUPAC name

2-[2-(2-{2-[(4-ethyl-2-oxo-2H-chromen-7-yl)oxy]acetamido}acetamido)acetamido]acetic acid

SMILES

CCC(c(ccc(OCC(NCC(NCC(NCC(O)=O)=O)=O)=O)c1)c1O1)=CC1=O

InChI

InChI=1S/C19H21N3O8/c1-2-11-5-19(28)30-14-6-12(3-4-13(11)14)29-10-17(25)21-8-15(23)20-7-16(24)22-9-18(26)27/h3-6H,2,7-10H2,1H3,(H,20,23)(H,21,25)(H,22,24)(H,26,27)

InChI Key

IANKJBJUGPLOEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10040740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.39

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

-0.222

Distribution Coefficient, logD

-4.150

Water Solubility, LogSw

-2.47

Polar Surface Area

129.943

Acid Dissociation Constant (pKa)

3.47

Base Dissociation Constant (pKb)

-0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with Y040-8500 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-8500?
Check Price and Availability of Y040-8500, 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 Y040-8500 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-8500
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-8500
  • 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 Y040-8500 available by request